CAS RN: 401589-92-2
CAS Name: N-cyclopropyl-3-nitrobenzenesulfonamide
OPENEYE Name: N-cyclopropyl-3-nitro-benzenesulfonamide
IUPAC Name: N-cyclopropyl-3-nitrobenzenesulfonamide
SYSTEMATIC NAME: N-cyclopropyl-3-nitro-benzenesulfonamide
MOLECULAR FORMULA: C9H10N2O4S
MOLECULAR WEIGHT: 242.2517
SMILES: C1CC1NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]
Structure:
CAS RN: 63675-17-2
CAS Name: 1-(2-ethylphenyl)-5-oxo-3-pyrrolidinecarboxylic acid
OPENEYE Name: 1-(2-ethylphenyl)-5-oxo-pyrrolidine-3-carboxylic acid
IUPAC Name: 1-(2-ethylphenyl)-5-oxopyrrolidine-3-carboxylic acid
SYSTEMATIC NAME: 1-(2-ethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylic acid
MOLECULAR FORMULA: C13H15NO3
MOLECULAR WEIGHT: 233.2631
SMILES: CCC1=CC=CC=C1N2CC(CC2=O)C(=O)O
Structure:
CAS RN: 5366-69-8
CAS Name: N-(3-chloro-4-methylphenyl)-2-[4-methyl-5-[[2-(4-nitroanilino)-2-oxoethyl]thio]-1,2,4-triazol-3-yl]acetamide
OPENEYE Name: N-(3-chloro-4-methyl-phenyl)-2-[4-methyl-5-[2-(4-nitroanilino)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]acetamide
IUPAC Name: N-(3-chloro-4-methylphenyl)-2-[4-methyl-5-[2-(4-nitroanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]acetamide
SYSTEMATIC NAME: N-(3-chloranyl-4-methyl-phenyl)-2-[4-methyl-5-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,2,4-triazol-3-yl]ethanamide
MOLECULAR FORMULA: C20H19ClN6O4S
MOLECULAR WEIGHT: 474.92066
SMILES: CC1=C(C=C(C=C1)NC(=O)CC2=NN=C(N2C)SCC(=O)NC3=CC=C(C=C3)[N+](=O)[O-])Cl
Structure:
CAS RN: 103980-60-5
CAS Name: 5-decyl-2,6-dimethyl-1H-pyrimidin-4-one
OPENEYE Name: 5-decyl-2,6-dimethyl-1H-pyrimidin-4-one
IUPAC Name: 5-decyl-2,6-dimethyl-1H-pyrimidin-4-one
SYSTEMATIC NAME: 5-decyl-2,6-dimethyl-1H-pyrimidin-4-one
MOLECULAR FORMULA: C16H28N2O
MOLECULAR WEIGHT: 264.40632
SMILES: CCCCCCCCCCC1=C(NC(=NC1=O)C)C
Structure:
CAS RN: 126480-58-8
CAS Name: 7-[4-imino-4-(4-morpholinyl)butyl]-1,3-dimethylpurine-2,6-dione hydrochloride
OPENEYE Name: 7-(4-imino-4-morpholino-butyl)-1,3-dimethyl-purine-2,6-dione hydrochloride
IUPAC Name: 7-(4-imino-4-morpholin-4-ylbutyl)-1,3-dimethylpurine-2,6-dione hydrochloride
SYSTEMATIC NAME: 7-(4-azanylidene-4-morpholin-4-yl-butyl)-1,3-dimethyl-purine-2,6-dione hydrochloride
MOLECULAR FORMULA: C15H23ClN6O3
MOLECULAR WEIGHT: 370.83452
SMILES: CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCCC(=N)N3CCOCC3.Cl
Structure:
CAS RN: 126480-53-3
CAS Name: 7-[2-imino-2-(1-piperidinyl)ethyl]-1,3-dimethylpurine-2,6-dione hydrochloride
OPENEYE Name: 7-[2-imino-2-(1-piperidyl)ethyl]-1,3-dimethyl-purine-2,6-dione hydrochloride
IUPAC Name: 7-(2-imino-2-piperidin-1-ylethyl)-1,3-dimethylpurine-2,6-dione hydrochloride
SYSTEMATIC NAME: 7-(2-azanylidene-2-piperidin-1-yl-ethyl)-1,3-dimethyl-purine-2,6-dione hydrochloride
MOLECULAR FORMULA: C14H21ClN6O2
MOLECULAR WEIGHT: 340.80854
SMILES: CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=N)N3CCCCC3.Cl
Structure:
CAS RN: 126480-52-2
CAS Name: 7-[2-imino-2-(4-morpholinyl)ethyl]-1,3-dimethylpurine-2,6-dione hydrochloride
OPENEYE Name: 7-(2-imino-2-morpholino-ethyl)-1,3-dimethyl-purine-2,6-dione hydrochloride
IUPAC Name: 7-(2-imino-2-morpholin-4-ylethyl)-1,3-dimethylpurine-2,6-dione hydrochloride
SYSTEMATIC NAME: 7-(2-azanylidene-2-morpholin-4-yl-ethyl)-1,3-dimethyl-purine-2,6-dione hydrochloride
MOLECULAR FORMULA: C13H19ClN6O3
MOLECULAR WEIGHT: 342.78136
SMILES: CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=N)N3CCOCC3.Cl
Structure:
CAS RN: 74039-63-7
CAS Name: 7-(2-aminoethyl)-1,3-dimethylpurine-2,6-dione hydrochloride
OPENEYE Name: 7-(2-aminoethyl)-1,3-dimethyl-purine-2,6-dione hydrochloride
IUPAC Name: 7-(2-aminoethyl)-1,3-dimethylpurine-2,6-dione hydrochloride
SYSTEMATIC NAME: 7-(2-azanylethyl)-1,3-dimethyl-purine-2,6-dione hydrochloride
MOLECULAR FORMULA: C9H14ClN5O2
MOLECULAR WEIGHT: 259.69276
SMILES: CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCN.Cl
Structure:
CAS RN: 101153-56-4
CAS Name: [4-(2-quinolinyl)-1-piperazinyl]-(3,4,5-trimethoxyphenyl)methanone hydrochloride
OPENEYE Name: [4-(2-quinolyl)piperazin-1-yl]-(3,4,5-trimethoxyphenyl)methanone hydrochloride
IUPAC Name: (4-quinolin-2-ylpiperazin-1-yl)-(3,4,5-trimethoxyphenyl)methanone hydrochloride
SYSTEMATIC NAME: (4-quinolin-2-ylpiperazin-1-yl)-(3,4,5-trimethoxyphenyl)methanone hydrochloride
MOLECULAR FORMULA: C23H26ClN3O4
MOLECULAR WEIGHT: 443.92324
SMILES: COC1=CC(=CC(=C1OC)OC)C(=O)N2CCN(CC2)C3=NC4=CC=CC=C4C=C3.Cl
Structure:
CAS RN: 80381-27-7
CAS Name: 3-hydroxy-2,2-diphenylpropanoic acid 1-azabicyclo[2.2.2]octan-3-yl ester hydrochloride
OPENEYE Name: quinuclidin-3-yl 3-hydroxy-2,2-diphenyl-propanoate hydrochloride
IUPAC Name: 1-azabicyclo[2.2.2]octan-3-yl 3-hydroxy-2,2-diphenylpropanoate hydrochloride
SYSTEMATIC NAME: 1-azabicyclo[2.2.2]octan-3-yl 3-oxidanyl-2,2-diphenyl-propanoate hydrochloride
MOLECULAR FORMULA: C22H26ClNO3
MOLECULAR WEIGHT: 387.89974
SMILES: C1CN2CCC1C(C2)OC(=O)C(CO)(C3=CC=CC=C3)C4=CC=CC=C4.Cl
Structure:
CAS RN: 22745-63-7
CAS Name: 3-amino-N,N-diethyl-4-(1-piperidinyl)benzenesulfonamide
OPENEYE Name: 3-amino-N,N-diethyl-4-(1-piperidyl)benzenesulfonamide
IUPAC Name: 3-amino-N,N-diethyl-4-piperidin-1-ylbenzenesulfonamide
SYSTEMATIC NAME: 3-azanyl-N,N-diethyl-4-piperidin-1-yl-benzenesulfonamide
MOLECULAR FORMULA: C15H25N3O2S
MOLECULAR WEIGHT: 311.4429
SMILES: CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCCC2)N
Structure:
CAS RN: 10372-41-5
CAS Name: 3-amino-N,N-diethylbenzenesulfonamide
OPENEYE Name: 3-amino-N,N-diethyl-benzenesulfonamide
IUPAC Name: 3-amino-N,N-diethylbenzenesulfonamide
SYSTEMATIC NAME: 3-azanyl-N,N-diethyl-benzenesulfonamide
MOLECULAR FORMULA: C10H16N2O2S
MOLECULAR WEIGHT: 228.31124
SMILES: CCN(CC)S(=O)(=O)C1=CC=CC(=C1)N
Structure:
CAS RN: 64511-38-2
CAS Name: N-[4-[3-[4-(4-chlorophenyl)-1-piperazinyl]-2-hydroxypropoxy]phenyl]acetamide
OPENEYE Name: N-[4-[3-[4-(4-chlorophenyl)piperazin-1-yl]-2-hydroxy-propoxy]phenyl]acetamide
IUPAC Name: N-[4-[3-[4-(4-chlorophenyl)piperazin-1-yl]-2-hydroxypropoxy]phenyl]acetamide
SYSTEMATIC NAME: N-[4-[3-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxidanyl-propoxy]phenyl]ethanamide
MOLECULAR FORMULA: C21H26ClN3O3
MOLECULAR WEIGHT: 403.90244
SMILES: CC(=O)NC1=CC=C(C=C1)OCC(CN2CCN(CC2)C3=CC=C(C=C3)Cl)O
Structure:
CAS RN: 4495-70-9
CAS Name: 3-acetyl-8,10-diamino-9-thia-3-azaspiro[5.5]undeca-7,10-diene-7,11-dicarbonitrile
OPENEYE Name: 3-acetyl-8,10-diamino-9-thia-3-azaspiro[5.5]undeca-7,10-diene-7,11-dicarbonitrile
IUPAC Name: 3-acetyl-8,10-diamino-9-thia-3-azaspiro[5.5]undeca-7,10-diene-7,11-dicarbonitrile
SYSTEMATIC NAME: 8,10-bis(azanyl)-3-ethanoyl-9-thia-3-azaspiro[5.5]undeca-7,10-diene-7,11-dicarbonitrile
MOLECULAR FORMULA: C13H15N5OS
MOLECULAR WEIGHT: 289.3561
SMILES: CC(=O)N1CCC2(CC1)C(=C(SC(=C2C#N)N)N)C#N
Structure:
CAS RN: 4493-88-3
CAS Name: 2-(1,3-dioxo-2-isoindolyl)acetic acid [[amino-(4-methoxyphenyl)methylidene]amino] ester
OPENEYE Name: [[amino-(4-methoxyphenyl)methylene]amino] 2-(1,3-dioxoisoindolin-2-yl)acetate
IUPAC Name: [[amino-(4-methoxyphenyl)methylidene]amino] 2-(1,3-dioxoisoindol-2-yl)acetate
SYSTEMATIC NAME: [[azanyl-(4-methoxyphenyl)methylidene]amino] 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethanoate
MOLECULAR FORMULA: C18H15N3O5
MOLECULAR WEIGHT: 353.3288
SMILES: COC1=CC=C(C=C1)C(=NOC(=O)CN2C(=O)C3=CC=CC=C3C2=O)N
Structure:
CAS RN: 4493-27-0
CAS Name: 2-chloro-N-[3-methyl-1-[5-[[2-[(5-methyl-4-phenyl-2-thiazolyl)amino]-2-oxoethyl]thio]-4-prop-2-enyl-1,2,4-triazol-3-yl]butyl]benzamide
OPENEYE Name: N-[1-[4-allyl-5-[2-[(5-methyl-4-phenyl-thiazol-2-yl)amino]-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]-3-methyl-butyl]-2-chloro-benzamide
IUPAC Name: 2-chloro-N-[3-methyl-1-[5-[2-[(5-methyl-4-phenyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]butyl]benzamide
SYSTEMATIC NAME: 2-chloranyl-N-[3-methyl-1-[5-[2-[(5-methyl-4-phenyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]butyl]benzamide
MOLECULAR FORMULA: C29H31ClN6O2S2
MOLECULAR WEIGHT: 595.17844
SMILES: CC1=C(N=C(S1)NC(=O)CSC2=NN=C(N2CC=C)C(CC(C)C)NC(=O)C3=CC=CC=C3Cl)C4=CC=CC=C4
Structure:
CAS RN: 72336-07-3
CAS Name: N-(phenylmethyl)-2-(1-pyrrolidinyl)acetamide hydrochloride
OPENEYE Name: N-benzyl-2-pyrrolidin-1-yl-acetamide hydrochloride
IUPAC Name: N-benzyl-2-pyrrolidin-1-ylacetamide hydrochloride
SYSTEMATIC NAME: N-(phenylmethyl)-2-pyrrolidin-1-yl-ethanamide hydrochloride
MOLECULAR FORMULA: C13H19ClN2O
MOLECULAR WEIGHT: 254.75576
SMILES: C1CCN(C1)CC(=O)NCC2=CC=CC=C2.Cl
Structure:
CAS RN: 72336-20-0
CAS Name: 2-(4-morpholinyl)-N-(phenylmethyl)acetamide
OPENEYE Name: N-benzyl-2-morpholino-acetamide
IUPAC Name: N-benzyl-2-morpholin-4-ylacetamide
SYSTEMATIC NAME: 2-morpholin-4-yl-N-(phenylmethyl)ethanamide
MOLECULAR FORMULA: C13H18N2O2
MOLECULAR WEIGHT: 234.29422
SMILES: C1COCCN1CC(=O)NCC2=CC=CC=C2
Structure:
CAS RN: 669708-93-4
CAS Name: 3-[1-(4-ethylphenoxy)ethyl]-4-methyl-1H-1,2,4-triazole-5-thione
OPENEYE Name: 3-[1-(4-ethylphenoxy)ethyl]-4-methyl-1H-1,2,4-triazole-5-thione
IUPAC Name: 3-[1-(4-ethylphenoxy)ethyl]-4-methyl-1H-1,2,4-triazole-5-thione
SYSTEMATIC NAME: 3-[1-(4-ethylphenoxy)ethyl]-4-methyl-1H-1,2,4-triazole-5-thione
MOLECULAR FORMULA: C13H17N3OS
MOLECULAR WEIGHT: 263.35858
SMILES: CCC1=CC=C(C=C1)OC(C)C2=NNC(=S)N2C
Structure:
CAS RN: 4903-83-7
CAS Name: 2-[3-oxo-1-[sulfanylidene-[3-(trifluoromethyl)anilino]methyl]-2-piperazinyl]acetic acid methyl ester
OPENEYE Name: methyl 2-[3-oxo-1-[[3-(trifluoromethyl)phenyl]carbamothioyl]piperazin-2-yl]acetate
IUPAC Name: methyl 2-[3-oxo-1-[[3-(trifluoromethyl)phenyl]carbamothioyl]piperazin-2-yl]acetate
SYSTEMATIC NAME: methyl 2-[3-oxidanylidene-1-[[3-(trifluoromethyl)phenyl]carbamothioyl]piperazin-2-yl]ethanoate
MOLECULAR FORMULA: C15H16F3N3O3S
MOLECULAR WEIGHT: 375.36605
SMILES: COC(=O)CC1C(=O)NCCN1C(=S)NC2=CC=CC(=C2)C(F)(F)F
Structure:
CAS RN: 108086-42-6
CAS Name: N-(2-nitrophenyl)-2-(4-oxo-3-quinazolinyl)acetamide
OPENEYE Name: N-(2-nitrophenyl)-2-(4-oxoquinazolin-3-yl)acetamide
IUPAC Name: N-(2-nitrophenyl)-2-(4-oxoquinazolin-3-yl)acetamide
SYSTEMATIC NAME: N-(2-nitrophenyl)-2-(4-oxidanylidenequinazolin-3-yl)ethanamide
MOLECULAR FORMULA: C16H12N4O4
MOLECULAR WEIGHT: 324.29088
SMILES: C1=CC=C2C(=C1)C(=O)N(C=N2)CC(=O)NC3=CC=CC=C3[N+](=O)[O-]
Structure:
CAS RN: 77905-46-5
CAS Name: 2-[(4-ethoxy-3-nitrophenyl)methyl-(2-hydroxyethyl)amino]ethanol hydrochloride
OPENEYE Name: 2-[(4-ethoxy-3-nitro-phenyl)methyl-(2-hydroxyethyl)amino]ethanol hydrochloride
IUPAC Name: 2-[(4-ethoxy-3-nitrophenyl)methyl-(2-hydroxyethyl)amino]ethanol hydrochloride
SYSTEMATIC NAME: 2-[(4-ethoxy-3-nitro-phenyl)methyl-(2-hydroxyethyl)amino]ethanol hydrochloride
MOLECULAR FORMULA: C13H21ClN2O5
MOLECULAR WEIGHT: 320.76924
SMILES: CCOC1=C(C=C(C=C1)CN(CCO)CCO)[N+](=O)[O-].Cl
Structure:
CAS RN: 5727-31-1
CAS Name: 2-(1-adamantyl)-1-[4-(4-chloro-2-nitrophenyl)-1-piperazinyl]ethanone
OPENEYE Name: 2-(1-adamantyl)-1-[4-(4-chloro-2-nitro-phenyl)piperazin-1-yl]ethanone
IUPAC Name: 2-(1-adamantyl)-1-[4-(4-chloro-2-nitrophenyl)piperazin-1-yl]ethanone
SYSTEMATIC NAME: 2-(1-adamantyl)-1-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]ethanone
MOLECULAR FORMULA: C22H28ClN3O3
MOLECULAR WEIGHT: 417.92902
SMILES: C1CN(CCN1C2=C(C=C(C=C2)Cl)[N+](=O)[O-])C(=O)CC34CC5CC(C3)CC(C5)C4
Structure:
No comments:
Post a Comment