CAS RN: 68427-04-3
CAS Name: (2S)-2-[[[2-[4-[bis(2-chloroethyl)amino]anilino]-1-oxoethyl]amino]-oxomethyl]-1-pyrrolidinecarboxylic acid (phenylmethyl) ester
OPENEYE Name: benzyl (2S)-2-[[2-[4-[bis(2-chloroethyl)amino]anilino]acetyl]carbamoyl]pyrrolidine-1-carboxylate
IUPAC Name: benzyl (2S)-2-[[2-[4-[bis(2-chloroethyl)amino]anilino]acetyl]carbamoyl]pyrrolidine-1-carboxylate
SYSTEMATIC NAME: (phenylmethyl) (2S)-2-[2-[[4-[bis(2-chloroethyl)amino]phenyl]amino]ethanoylcarbamoyl]pyrrolidine-1-carboxylate
MOLECULAR FORMULA: C25H30Cl2N4O4
MOLECULAR WEIGHT: 521.4361
SMILES: C1C[C@H](N(C1)C(=O)OCC2=CC=CC=C2)C(=O)NC(=O)CNC3=CC=C(C=C3)N(CCCl)CCCl
Structure:
CAS RN: 68427-02-1
CAS Name: (2S)-1-[2-[[(2S)-2-[[[(2S)-1-[(2R)-2-amino-1-oxo-3-phenylpropyl]-2-pyrrolidinyl]-oxomethyl]amino]-4-methyl-1-oxopentyl]amino]-1-oxoethyl]-N-[2-[4-[bis(2-chloroethyl)amino]anilino]-1-oxoethyl]-2-pyrrolidinecarboxamide
OPENEYE Name: (2S)-1-[2-[[(2S)-2-[[(2S)-1-[(2R)-2-amino-3-phenyl-propanoyl]pyrrolidine-2-carbonyl]amino]-4-methyl-pentanoyl]amino]acetyl]-N-[2-[4-[bis(2-chloroethyl)amino]anilino]acetyl]pyrrolidine-2-carboxamide
IUPAC Name: (2S)-1-[2-[[(2S)-2-[[(2S)-1-[(2R)-2-amino-3-phenylpropanoyl]pyrrolidine-2-carbonyl]amino]-4-methylpentanoyl]amino]acetyl]-N-[2-[4-[bis(2-chloroethyl)amino]anilino]acetyl]pyrrolidine-2-carboxamide
SYSTEMATIC NAME: (2S)-1-[2-[[(2S)-2-[[(2S)-1-[(2R)-2-azanyl-3-phenyl-propanoyl]pyrrolidin-2-yl]carbonylamino]-4-methyl-pentanoyl]amino]ethanoyl]-N-[2-[[4-[bis(2-chloroethyl)amino]phenyl]amino]ethanoyl]pyrrolidine-2-carboxamide
MOLECULAR FORMULA: C39H54Cl2N8O6
MOLECULAR WEIGHT: 801.80206
SMILES: CC(C)C[C@@H](C(=O)NCC(=O)N1CCC[C@H]1C(=O)NC(=O)CNC2=CC=C(C=C2)N(CCCl)CCCl)NC(=O)[C@@H]3CCCN3C(=O)[C@@H](CC4=CC=CC=C4)N
Structure:
CAS RN: 68427-01-0
CAS Name: N-[(2R)-1-[(2S)-2-[[[(2S)-1-[[2-[(2S)-2-[[[2-[4-[bis(2-chloroethyl)amino]anilino]-1-oxoethyl]amino]-oxomethyl]-1-pyrrolidinyl]-2-oxoethyl]amino]-4-methyl-1-oxopentan-2-yl]amino]-oxomethyl]-1-pyrrolidinyl]-1-oxo-3-phenylpropan-2-yl]carbamic acid tert-butyl
OPENEYE Name: tert-butyl N-[(1R)-1-benzyl-2-[(2S)-2-[[(1S)-1-[[2-[(2S)-2-[[2-[4-[bis(2-chloroethyl)amino]anilino]acetyl]carbamoyl]pyrrolidin-1-yl]-2-oxo-ethyl]carbamoyl]-3-methyl-butyl]carbamoyl]pyrrolidin-1-yl]-2-oxo-ethyl]carbamate
IUPAC Name: tert-butyl N-[(2R)-1-[(2S)-2-[[(2S)-1-[[2-[(2S)-2-[[2-[4-[bis(2-chloroethyl)amino]anilino]acetyl]carbamoyl]pyrrolidin-1-yl]-2-oxoethyl]amino]-4-methyl-1-oxopentan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxo-3-phenylpropan-2-yl]carbamate
SYSTEMATIC NAME: tert-butyl N-[(2R)-1-[(2S)-2-[[(2S)-1-[[2-[(2S)-2-[2-[[4-[bis(2-chloroethyl)amino]phenyl]amino]ethanoylcarbamoyl]pyrrolidin-1-yl]-2-oxidanylidene-ethyl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxidanylidene-3-phenyl-propan-
MOLECULAR FORMULA: C44H62Cl2N8O8
MOLECULAR WEIGHT: 901.91788
SMILES: CC(C)C[C@@H](C(=O)NCC(=O)N1CCC[C@H]1C(=O)NC(=O)CNC2=CC=C(C=C2)N(CCCl)CCCl)NC(=O)[C@@H]3CCCN3C(=O)[C@@H](CC4=CC=CC=C4)NC(=O)OC(C)(C)C
Structure:
CAS RN: 68427-00-9
CAS Name: N-[(2R)-1-[(2S)-2-[[[(2S)-1-[[2-[(2S)-2-[[[2-[4-[bis(2-chloroethyl)amino]anilino]-1-oxoethyl]amino]-oxomethyl]-1-pyrrolidinyl]-2-oxoethyl]amino]-4-methyl-1-oxopentan-2-yl]amino]-oxomethyl]-1-pyrrolidinyl]-6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-ox
OPENEYE Name: tert-butyl N-[(1R)-1-[(2S)-2-[[(1S)-1-[[2-[(2S)-2-[[2-[4-[bis(2-chloroethyl)amino]anilino]acetyl]carbamoyl]pyrrolidin-1-yl]-2-oxo-ethyl]carbamoyl]-3-methyl-butyl]carbamoyl]pyrrolidine-1-carbonyl]-5-(tert-butoxycarbonylamino)pentyl]carbamate
IUPAC Name: tert-butyl N-[(2R)-1-[(2S)-2-[[(2S)-1-[[2-[(2S)-2-[[2-[4-[bis(2-chloroethyl)amino]anilino]acetyl]carbamoyl]pyrrolidin-1-yl]-2-oxoethyl]amino]-4-methyl-1-oxopentan-2-yl]carbamoyl]pyrrolidin-1-yl]-6-[(2-methylpropan-2-yl)oxycarbonylamino]-1-oxohexan-2-yl]ca
SYSTEMATIC NAME: tert-butyl N-[(2R)-1-[(2S)-2-[[(2S)-1-[[2-[(2S)-2-[2-[[4-[bis(2-chloroethyl)amino]phenyl]amino]ethanoylcarbamoyl]pyrrolidin-1-yl]-2-oxidanylidene-ethyl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]carbamoyl]pyrrolidin-1-yl]-6-[(2-methylpropan-2-yl)oxycarbo
MOLECULAR FORMULA: C46H73Cl2N9O10
MOLECULAR WEIGHT: 983.03212
SMILES: CC(C)C[C@@H](C(=O)NCC(=O)N1CCC[C@H]1C(=O)NC(=O)CNC2=CC=C(C=C2)N(CCCl)CCCl)NC(=O)[C@@H]3CCCN3C(=O)[C@@H](CCCCNC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C
Structure:
CAS RN: 68426-99-3
CAS Name: N-[(2R)-1-[(2S)-2-[[[(2S)-1-[[2-[(2S)-2-[[[2-[4-[bis(2-chloroethyl)amino]anilino]-1-oxoethyl]amino]-oxomethyl]-1-pyrrolidinyl]-2-oxoethyl]amino]-4-methyl-1-oxopentan-2-yl]amino]-oxomethyl]-1-pyrrolidinyl]-1-oxopropan-2-yl]carbamic acid tert-butyl ester
OPENEYE Name: tert-butyl N-[(1R)-2-[(2S)-2-[[(1S)-1-[[2-[(2S)-2-[[2-[4-[bis(2-chloroethyl)amino]anilino]acetyl]carbamoyl]pyrrolidin-1-yl]-2-oxo-ethyl]carbamoyl]-3-methyl-butyl]carbamoyl]pyrrolidin-1-yl]-1-methyl-2-oxo-ethyl]carbamate
IUPAC Name: tert-butyl N-[(2R)-1-[(2S)-2-[[(2S)-1-[[2-[(2S)-2-[[2-[4-[bis(2-chloroethyl)amino]anilino]acetyl]carbamoyl]pyrrolidin-1-yl]-2-oxoethyl]amino]-4-methyl-1-oxopentan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]carbamate
SYSTEMATIC NAME: tert-butyl N-[(2R)-1-[(2S)-2-[[(2S)-1-[[2-[(2S)-2-[2-[[4-[bis(2-chloroethyl)amino]phenyl]amino]ethanoylcarbamoyl]pyrrolidin-1-yl]-2-oxidanylidene-ethyl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxidanylidene-propan-2-yl]carb
MOLECULAR FORMULA: C38H58Cl2N8O8
MOLECULAR WEIGHT: 825.82192
SMILES: C[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N2CCC[C@H]2C(=O)NC(=O)CNC3=CC=C(C=C3)N(CCCl)CCCl)NC(=O)OC(C)(C)C
Structure:
CAS RN: 68426-98-2
CAS Name: (2S)-N-[2-[4-[bis(2-chloroethyl)amino]anilino]-1-oxoethyl]-1-[2-[[(2S)-2-[[[(2S)-1-[(2R)-2,6-diamino-1-oxohexyl]-2-pyrrolidinyl]-oxomethyl]amino]-4-methyl-1-oxopentyl]amino]-1-oxoethyl]-2-pyrrolidinecarboxamide; 2,2,2-trifluoroacetic acid
OPENEYE Name: (2S)-N-[2-[4-[bis(2-chloroethyl)amino]anilino]acetyl]-1-[2-[[(2S)-2-[[(2S)-1-[(2R)-2,6-diaminohexanoyl]pyrrolidine-2-carbonyl]amino]-4-methyl-pentanoyl]amino]acetyl]pyrrolidine-2-carboxamide; 2,2,2-trifluoroacetic acid
IUPAC Name: (2S)-N-[2-[4-[bis(2-chloroethyl)amino]anilino]acetyl]-1-[2-[[(2S)-2-[[(2S)-1-[(2R)-2,6-diaminohexanoyl]pyrrolidine-2-carbonyl]amino]-4-methylpentanoyl]amino]acetyl]pyrrolidine-2-carboxamide; 2,2,2-trifluoroacetic acid
SYSTEMATIC NAME: (2S)-1-[2-[[(2S)-2-[[(2S)-1-[(2R)-2,6-bis(azanyl)hexanoyl]pyrrolidin-2-yl]carbonylamino]-4-methyl-pentanoyl]amino]ethanoyl]-N-[2-[[4-[bis(2-chloroethyl)amino]phenyl]amino]ethanoyl]pyrrolidine-2-carboxamide; 2,2,2-tris(fluoranyl)ethanoic acid
MOLECULAR FORMULA: C38H58Cl2F3N9O8
MOLECULAR WEIGHT: 896.82383
SMILES: CC(C)C[C@@H](C(=O)NCC(=O)N1CCC[C@H]1C(=O)NC(=O)CNC2=CC=C(C=C2)N(CCCl)CCCl)NC(=O)[C@@H]3CCCN3C(=O)[C@@H](CCCCN)N.C(=O)(C(F)(F)F)O
Structure:
CAS RN: 68426-96-0
CAS Name: (2S)-1-(2-amino-1-oxoethyl)-N-[2-[4-[bis(2-chloroethyl)amino]anilino]-1-oxoethyl]-2-pyrrolidinecarboxamide; 2,2,2-trifluoroacetic acid
OPENEYE Name: (2S)-1-(2-aminoacetyl)-N-[2-[4-[bis(2-chloroethyl)amino]anilino]acetyl]pyrrolidine-2-carboxamide; 2,2,2-trifluoroacetic acid
IUPAC Name: (2S)-1-(2-aminoacetyl)-N-[2-[4-[bis(2-chloroethyl)amino]anilino]acetyl]pyrrolidine-2-carboxamide; 2,2,2-trifluoroacetic acid
SYSTEMATIC NAME: (2S)-1-(2-azanylethanoyl)-N-[2-[[4-[bis(2-chloroethyl)amino]phenyl]amino]ethanoyl]pyrrolidine-2-carboxamide; 2,2,2-tris(fluoranyl)ethanoic acid
MOLECULAR FORMULA: C21H28Cl2F3N5O5
MOLECULAR WEIGHT: 558.37873
SMILES: C1C[C@H](N(C1)C(=O)CN)C(=O)NC(=O)CNC2=CC=C(C=C2)N(CCCl)CCCl.C(=O)(C(F)(F)F)O
Structure:
CAS RN: 68426-94-8
CAS Name: (2S)-1-[2-[[(2S)-2-amino-4-methyl-1-oxopentyl]amino]-1-oxoethyl]-N-[2-[4-[bis(2-chloroethyl)amino]anilino]-1-oxoethyl]-2-pyrrolidinecarboxamide; 2,2,2-trifluoroacetic acid
OPENEYE Name: (2S)-1-[2-[[(2S)-2-amino-4-methyl-pentanoyl]amino]acetyl]-N-[2-[4-[bis(2-chloroethyl)amino]anilino]acetyl]pyrrolidine-2-carboxamide; 2,2,2-trifluoroacetic acid
IUPAC Name: (2S)-1-[2-[[(2S)-2-amino-4-methylpentanoyl]amino]acetyl]-N-[2-[4-[bis(2-chloroethyl)amino]anilino]acetyl]pyrrolidine-2-carboxamide; 2,2,2-trifluoroacetic acid
SYSTEMATIC NAME: (2S)-1-[2-[[(2S)-2-azanyl-4-methyl-pentanoyl]amino]ethanoyl]-N-[2-[[4-[bis(2-chloroethyl)amino]phenyl]amino]ethanoyl]pyrrolidine-2-carboxamide; 2,2,2-tris(fluoranyl)ethanoic acid
MOLECULAR FORMULA: C27H39Cl2F3N6O6
MOLECULAR WEIGHT: 671.53637
SMILES: CC(C)C[C@@H](C(=O)NCC(=O)N1CCC[C@H]1C(=O)NC(=O)CNC2=CC=C(C=C2)N(CCCl)CCCl)N.C(=O)(C(F)(F)F)O
Structure:
CAS RN: 68407-08-9
CAS Name: 1-(diaminomethylidene)-3-(2,6-dimethylphenyl)urea hydrochloride
OPENEYE Name: 1-(diaminomethylene)-3-(2,6-dimethylphenyl)urea hydrochloride
IUPAC Name: 1-(diaminomethylidene)-3-(2,6-dimethylphenyl)urea hydrochloride
SYSTEMATIC NAME: 1-[bis(azanyl)methylidene]-3-(2,6-dimethylphenyl)urea hydrochloride
MOLECULAR FORMULA: C10H15ClN4O
MOLECULAR WEIGHT: 242.7053
SMILES: CC1=C(C(=CC=C1)C)NC(=O)N=C(N)N.Cl
Structure:
CAS RN: 68406-27-9
CAS Name: (2S,3R,4S,5S,6R)-2-[[(2R,3R,4S,5S,6R)-2-[[(6R,10R,12S,14R,17S)-3,12-dihydroxy-4,4,10,14,15-pentamethyl-17-[(2S)-6-methyl-2-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]hept-5-en-2-yl]-1,2,3,5,6,7,8,9,11,12,13,15,16,17-tetradecahydroc
OPENEYE Name: (2S,3R,4S,5S,6R)-2-[(2R,3R,4S,5S,6R)-2-[[(6R,10R,12S,14R,17S)-17-[(1S)-1,5-dimethyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-hex-4-enyl]-3,12-dihydroxy-4,4,10,14,15-pentamethyl-1,2,3,5,6,7,8,9,11,12,13,15,16,17-tetrad
IUPAC Name: (2S,3R,4S,5S,6R)-2-[(2R,3R,4S,5S,6R)-2-[[(6R,10R,12S,14R,17S)-3,12-dihydroxy-4,4,10,14,15-pentamethyl-17-[(2S)-6-methyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhept-5-en-2-yl]-1,2,3,5,6,7,8,9,11,12,13,15,16,17-tetradecahydrocycl
SYSTEMATIC NAME: (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[(2R,3R,4S,5S,6R)-6-(hydroxymethyl)-2-[[(6R,10R,12S,14R,17S)-17-[(2S)-2-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-6-methyl-hept-5-en-2-yl]-4,4,10,14,15-pentamethyl-3,12-bis(oxidanyl)-1,2,3,5
MOLECULAR FORMULA: C48H82O19
MOLECULAR WEIGHT: 963.15328
SMILES: CC1C[C@@H](C2[C@]1(C3C[C@H](C4[C@@](C3C[C@@H]2O)(CCC(C4(C)C)O)C)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)C)[C@](C)(CCC=C(C)C)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O
Structure:
CAS RN: 68398-30-1
CAS Name: 2-[2-(6,6-dimethyl-4-bicyclo[3.1.1]hept-3-enyl)ethoxy]-N,N-dimethylethanamine; 2-hydroxypropane-1,2,3-tricarboxylic acid
OPENEYE Name: citric acid; 2-[2-(6,6-dimethyl-4-bicyclo[3.1.1]hept-3-enyl)ethoxy]-N,N-dimethyl-ethanamine
IUPAC Name: 2-[2-(6,6-dimethyl-4-bicyclo[3.1.1]hept-3-enyl)ethoxy]-N,N-dimethylethanamine; 2-hydroxypropane-1,2,3-tricarboxylic acid
SYSTEMATIC NAME: 2-[2-(6,6-dimethyl-4-bicyclo[3.1.1]hept-3-enyl)ethoxy]-N,N-dimethyl-ethanamine; 2-oxidanylpropane-1,2,3-tricarboxylic acid
MOLECULAR FORMULA: C21H35NO8
MOLECULAR WEIGHT: 429.5045
SMILES: CC1(C2CC=C(C1C2)CCOCCN(C)C)C.C(C(=O)O)C(CC(=O)O)(C(=O)O)O
Structure:
CAS RN: 68398-25-4
CAS Name: (5R)-8-methyl-4-thiophen-2-yl-8-azabicyclo[3.2.1]octane-3-carboxylic acid methyl ester hydrochloride
OPENEYE Name: methyl (5R)-8-methyl-4-(2-thienyl)-8-azabicyclo[3.2.1]octane-3-carboxylate hydrochloride
IUPAC Name: methyl (5R)-8-methyl-4-thiophen-2-yl-8-azabicyclo[3.2.1]octane-3-carboxylate hydrochloride
SYSTEMATIC NAME: methyl (5R)-8-methyl-4-thiophen-2-yl-8-azabicyclo[3.2.1]octane-3-carboxylate hydrochloride
MOLECULAR FORMULA: C14H20ClNO2S
MOLECULAR WEIGHT: 301.8321
SMILES: CN1[C@@H]2CCC1CC(C2C3=CC=CS3)C(=O)OC.Cl
Structure:
CAS RN: 68398-24-3
CAS Name: (5S)-8-methyl-4-thiophen-2-yl-8-azabicyclo[3.2.1]octane-3-carboxylic acid methyl ester hydrochloride
OPENEYE Name: methyl (5S)-8-methyl-4-(2-thienyl)-8-azabicyclo[3.2.1]octane-3-carboxylate hydrochloride
IUPAC Name: methyl (5S)-8-methyl-4-thiophen-2-yl-8-azabicyclo[3.2.1]octane-3-carboxylate hydrochloride
SYSTEMATIC NAME: methyl (5S)-8-methyl-4-thiophen-2-yl-8-azabicyclo[3.2.1]octane-3-carboxylate hydrochloride
MOLECULAR FORMULA: C14H20ClNO2S
MOLECULAR WEIGHT: 301.8321
SMILES: CN1[C@H]2CCC1CC(C2C3=CC=CS3)C(=O)OC.Cl
Structure:
CAS RN: 68398-09-4
CAS Name: N-[(4-fluorophenyl)methyl]-2-methyl-1-phenyl-2-propanamine hydrochloride
OPENEYE Name: N-[(4-fluorophenyl)methyl]-2-methyl-1-phenyl-propan-2-amine hydrochloride
IUPAC Name: N-[(4-fluorophenyl)methyl]-2-methyl-1-phenylpropan-2-amine hydrochloride
SYSTEMATIC NAME: N-[(4-fluorophenyl)methyl]-2-methyl-1-phenyl-propan-2-amine hydrochloride
MOLECULAR FORMULA: C17H21ClFN
MOLECULAR WEIGHT: 293.806743
SMILES: CC(C)(CC1=CC=CC=C1)NCC2=CC=C(C=C2)F.Cl
Structure:
CAS RN: 68398-06-1
CAS Name: N-[(4-fluorophenyl)methyl]-2-phenylethanamine hydrochloride
OPENEYE Name: N-[(4-fluorophenyl)methyl]-2-phenyl-ethanamine hydrochloride
IUPAC Name: N-[(4-fluorophenyl)methyl]-2-phenylethanamine hydrochloride
SYSTEMATIC NAME: N-[(4-fluorophenyl)methyl]-2-phenyl-ethanamine hydrochloride
MOLECULAR FORMULA: C15H17ClFN
MOLECULAR WEIGHT: 265.753583
SMILES: C1=CC=C(C=C1)CCNCC2=CC=C(C=C2)F.Cl
Structure:
CAS RN: 68398-05-0
CAS Name: N,N-dimethyl-4-[(1-phenylpropan-2-ylamino)methyl]aniline dihydrochloride
OPENEYE Name: N,N-dimethyl-4-[[(1-methyl-2-phenyl-ethyl)amino]methyl]aniline dihydrochloride
IUPAC Name: N,N-dimethyl-4-[(1-phenylpropan-2-ylamino)methyl]aniline dihydrochloride
SYSTEMATIC NAME: N,N-dimethyl-4-[(1-phenylpropan-2-ylamino)methyl]aniline dihydrochloride
MOLECULAR FORMULA: C18H26Cl2N2
MOLECULAR WEIGHT: 341.31844
SMILES: CC(CC1=CC=CC=C1)NCC2=CC=C(C=C2)N(C)C.Cl.Cl
Structure:
CAS RN: 68398-00-5
CAS Name: 1-(4-chlorophenyl)-N-[(3,4-dimethoxyphenyl)methyl]-2-methyl-2-propanamine hydrochloride
OPENEYE Name: 1-(4-chlorophenyl)-N-[(3,4-dimethoxyphenyl)methyl]-2-methyl-propan-2-amine hydrochloride
IUPAC Name: 1-(4-chlorophenyl)-N-[(3,4-dimethoxyphenyl)methyl]-2-methylpropan-2-amine hydrochloride
SYSTEMATIC NAME: 1-(4-chlorophenyl)-N-[(3,4-dimethoxyphenyl)methyl]-2-methyl-propan-2-amine hydrochloride
MOLECULAR FORMULA: C19H25Cl2NO2
MOLECULAR WEIGHT: 370.3133
SMILES: CC(C)(CC1=CC=C(C=C1)Cl)NCC2=CC(=C(C=C2)OC)OC.Cl
Structure:
CAS RN: 68397-98-8
CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-2-methyl-1-phenyl-2-propanamine hydrochloride
OPENEYE Name: N-[(3,4-dimethoxyphenyl)methyl]-2-methyl-1-phenyl-propan-2-amine hydrochloride
IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-2-methyl-1-phenylpropan-2-amine hydrochloride
SYSTEMATIC NAME: N-[(3,4-dimethoxyphenyl)methyl]-2-methyl-1-phenyl-propan-2-amine hydrochloride
MOLECULAR FORMULA: C19H26ClNO2
MOLECULAR WEIGHT: 335.86824
SMILES: CC(C)(CC1=CC=CC=C1)NCC2=CC(=C(C=C2)OC)OC.Cl
Structure:
CAS RN: 68397-97-7
CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-1-phenyl-2-propanamine hydrochloride
OPENEYE Name: N-[(3,4-dimethoxyphenyl)methyl]-1-phenyl-propan-2-amine hydrochloride
IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-1-phenylpropan-2-amine hydrochloride
SYSTEMATIC NAME: N-[(3,4-dimethoxyphenyl)methyl]-1-phenyl-propan-2-amine hydrochloride
MOLECULAR FORMULA: C18H24ClNO2
MOLECULAR WEIGHT: 321.84166
SMILES: CC(CC1=CC=CC=C1)NCC2=CC(=C(C=C2)OC)OC.Cl
Structure:
CAS RN: 68397-96-6
CAS Name: 2-methyl-1-phenyl-N-[(3,4,5-trimethoxyphenyl)methyl]-2-propanamine hydrochloride
OPENEYE Name: 2-methyl-1-phenyl-N-[(3,4,5-trimethoxyphenyl)methyl]propan-2-amine hydrochloride
IUPAC Name: 2-methyl-1-phenyl-N-[(3,4,5-trimethoxyphenyl)methyl]propan-2-amine hydrochloride
SYSTEMATIC NAME: 2-methyl-1-phenyl-N-[(3,4,5-trimethoxyphenyl)methyl]propan-2-amine hydrochloride
MOLECULAR FORMULA: C20H28ClNO3
MOLECULAR WEIGHT: 365.89422
SMILES: CC(C)(CC1=CC=CC=C1)NCC2=CC(=C(C(=C2)OC)OC)OC.Cl
Structure:
CAS RN: 68397-94-4
CAS Name: N-[(4-methoxyphenyl)methyl]-2-methyl-1-phenyl-2-propanamine hydrochloride
OPENEYE Name: N-[(4-methoxyphenyl)methyl]-2-methyl-1-phenyl-propan-2-amine hydrochloride
IUPAC Name: N-[(4-methoxyphenyl)methyl]-2-methyl-1-phenylpropan-2-amine hydrochloride
SYSTEMATIC NAME: N-[(4-methoxyphenyl)methyl]-2-methyl-1-phenyl-propan-2-amine hydrochloride
MOLECULAR FORMULA: C18H24ClNO
MOLECULAR WEIGHT: 305.84226
SMILES: CC(C)(CC1=CC=CC=C1)NCC2=CC=C(C=C2)OC.Cl
Structure:
CAS RN: 436099-99-9
CAS Name: N,N-dimethyl-4-[(2-phenylethylamino)methyl]aniline
OPENEYE Name: N,N-dimethyl-4-[(2-phenylethylamino)methyl]aniline
IUPAC Name: N,N-dimethyl-4-[(2-phenylethylamino)methyl]aniline
SYSTEMATIC NAME: N,N-dimethyl-4-[(2-phenylethylamino)methyl]aniline
MOLECULAR FORMULA: C17H22N2
MOLECULAR WEIGHT: 254.36998
SMILES: CN(C)C1=CC=C(C=C1)CNCCC2=CC=CC=C2
Structure:
CAS RN: 68388-63-6
CAS Name: (2S)-2-[[[4-[(2,4-diamino-6-pteridinyl)methyl-methylamino]phenyl]-oxomethyl]amino]-3-phenylpropanoic acid
OPENEYE Name: (2S)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methyl-amino]benzoyl]amino]-3-phenyl-propanoic acid
IUPAC Name: (2S)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-3-phenylpropanoic acid
SYSTEMATIC NAME: (2S)-2-[[4-[[2,4-bis(azanyl)pteridin-6-yl]methyl-methyl-amino]phenyl]carbonylamino]-3-phenyl-propanoic acid
MOLECULAR FORMULA: C24H24N8O3
MOLECULAR WEIGHT: 472.49916
SMILES: CN(CC1=CN=C2C(=N1)C(=NC(=N2)N)N)C3=CC=C(C=C3)C(=O)N[C@@H](CC4=CC=CC=C4)C(=O)O
Structure:
CAS RN: 68380-39-2
CAS Name: acetic acid [2-acetyloxy-3-(2,3-diacetyloxy-5-methylphenoxy)-5-methylphenyl] ester
OPENEYE Name: [2-acetoxy-3-(2,3-diacetoxy-5-methyl-phenoxy)-5-methyl-phenyl] acetate
IUPAC Name: [2-acetyloxy-3-(2,3-diacetyloxy-5-methylphenoxy)-5-methylphenyl] acetate
SYSTEMATIC NAME: [2-acetyloxy-3-(2,3-diacetyloxy-5-methyl-phenoxy)-5-methyl-phenyl] ethanoate
MOLECULAR FORMULA: C22H22O9
MOLECULAR WEIGHT: 430.40468
SMILES: CC1=CC(=C(C(=C1)OC(=O)C)OC(=O)C)OC2=C(C(=CC(=C2)C)OC(=O)C)OC(=O)C
Structure:
CAS RN: 68366-40-5
CAS Name: (5R)-8-methyl-4-phenyl-8-azabicyclo[3.2.1]octane-3-carboxylic acid methyl ester
OPENEYE Name: methyl (5R)-8-methyl-4-phenyl-8-azabicyclo[3.2.1]octane-3-carboxylate
IUPAC Name: methyl (5R)-8-methyl-4-phenyl-8-azabicyclo[3.2.1]octane-3-carboxylate
SYSTEMATIC NAME: methyl (5R)-8-methyl-4-phenyl-8-azabicyclo[3.2.1]octane-3-carboxylate
MOLECULAR FORMULA: C16H21NO2
MOLECULAR WEIGHT: 259.34344
SMILES: CN1[C@@H]2CCC1CC(C2C3=CC=CC=C3)C(=O)OC
Structure:
CAS RN: 68353-77-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H24N4O2
MOLECULAR WEIGHT: 340.41946
SMILES: CCCN1C[C@@H](CC2[C@H]1CC3=CN(C4=CC=CC2=C34)N=O)CC(=O)N
Structure:
CAS RN: 68353-00-4
CAS Name: (2S)-2-[[(2S)-2-[[[4-[(2,4-diamino-6-pteridinyl)methyl-methylamino]phenyl]-oxomethyl]amino]-4-methyl-1-oxopentyl]amino]pentanedioic acid
OPENEYE Name: (2S)-2-[[(2S)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methyl-amino]benzoyl]amino]-4-methyl-pentanoyl]amino]pentanedioic acid
IUPAC Name: (2S)-2-[[(2S)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-4-methylpentanoyl]amino]pentanedioic acid
SYSTEMATIC NAME: (2S)-2-[[(2S)-2-[[4-[[2,4-bis(azanyl)pteridin-6-yl]methyl-methyl-amino]phenyl]carbonylamino]-4-methyl-pentanoyl]amino]pentanedioic acid
MOLECULAR FORMULA: C26H33N9O6
MOLECULAR WEIGHT: 567.59692
SMILES: CC(C)C[C@@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)C1=CC=C(C=C1)N(C)CC2=CN=C3C(=N2)C(=NC(=N3)N)N
Structure:
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