CAS RN: 6947-79-1
CAS Name: 5-chloro-N-(3-methylbutan-2-yl)-1-pentanamine hydrochloride
OPENEYE Name: 5-chloro-N-(1,2-dimethylpropyl)pentan-1-amine hydrochloride
IUPAC Name: 5-chloro-N-(3-methylbutan-2-yl)pentan-1-amine hydrochloride
SYSTEMATIC NAME: 5-chloranyl-N-(3-methylbutan-2-yl)pentan-1-amine hydrochloride
MOLECULAR FORMULA: C10H23Cl2N
MOLECULAR WEIGHT: 228.20232
SMILES: CC(C)C(C)NCCCCCCl.Cl
Structure:
CAS RN: 6947-78-0
CAS Name: N-(3-bromopropyl)-2,2-dimethyl-1-propanamine hydrobromide
OPENEYE Name: N-(3-bromopropyl)-2,2-dimethyl-propan-1-amine hydrobromide
IUPAC Name: N-(3-bromopropyl)-2,2-dimethylpropan-1-amine hydrobromide
SYSTEMATIC NAME: N-(3-bromanylpropyl)-2,2-dimethyl-propan-1-amine hydrobromide
MOLECULAR FORMULA: C8H19Br2N
MOLECULAR WEIGHT: 289.05116
SMILES: CC(C)(C)CNCCCBr.Br
Structure:
CAS RN: 3063-89-6
CAS Name: carbamimidothioic acid [10-[(carbamimidoylthio)methyl]-9-anthracenyl]methyl ester chloride
OPENEYE Name: 2-[[10-(carbamimidoylsulfanylmethyl)-9-anthryl]methyl]isothiourea chloride
IUPAC Name: [10-(carbamimidoylsulfanylmethyl)anthracen-9-yl]methyl carbamimidothioate chloride
SYSTEMATIC NAME: [10-(carbamimidoylsulfanylmethyl)anthracen-9-yl]methyl carbamimidothioate chloride
MOLECULAR FORMULA: C18H18ClN4S2-
MOLECULAR WEIGHT: 389.94532
SMILES: C1=CC=C2C(=C1)C(=C3C=CC=CC3=C2CSC(=N)N)CSC(=N)N.[Cl-]
Structure:
CAS RN: 6947-92-8
CAS Name: hexadecyl-dimethyl-(phenylmethyl)ammonium; hydroxy-oxido-oxo-sulfanylidene-$l^{6}-sulfane
OPENEYE Name: benzyl-hexadecyl-dimethyl-ammonium; hydroxy-oxido-oxo-thioxo-$l^{6}-sulfane
IUPAC Name: benzyl-hexadecyl-dimethylazanium; hydroxy-oxido-oxo-sulfanylidene-$l^{6}-sulfane
SYSTEMATIC NAME: hexadecyl-dimethyl-(phenylmethyl)azanium; oxidanidyl-oxidanyl-oxidanylidene-sulfanylidene-$l^{6}-sulfane
MOLECULAR FORMULA: C25H47NO3S2
MOLECULAR WEIGHT: 473.77558
SMILES: CCCCCCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1.OS(=O)(=S)[O-]
Structure:
CAS RN: 6947-88-2
CAS Name: dihydrogen phosphate; 6-methyl-4-(4-methylphenyl)-2-phenyl-1-benzothiopyrylium
OPENEYE Name: dihydrogen phosphate; 6-methyl-2-phenyl-4-(p-tolyl)thiochromenylium
IUPAC Name: dihydrogen phosphate; 6-methyl-4-(4-methylphenyl)-2-phenylthiochromenylium
SYSTEMATIC NAME: dihydrogen phosphate; 6-methyl-4-(4-methylphenyl)-2-phenyl-thiochromenylium
MOLECULAR FORMULA: C23H21O4PS
MOLECULAR WEIGHT: 424.449201
SMILES: CC1=CC=C(C=C1)C2=CC(=[S+]C3=C2C=C(C=C3)C)C4=CC=CC=C4.OP(=O)(O)[O-]
Structure:
CAS RN: 3337-97-1
CAS Name: 9-phenylthioxanthen-10-ium iodide
OPENEYE Name: 9-phenylthioxanthen-10-ium iodide
IUPAC Name: 9-phenylthioxanthen-10-ium iodide
SYSTEMATIC NAME: 9-phenylthioxanthen-10-ium iodide
MOLECULAR FORMULA: C19H13IS
MOLECULAR WEIGHT: 400.27599
SMILES: C1=CC=C(C=C1)C2=C3C=CC=CC3=[S+]C4=CC=CC=C42.[I-]
Structure:
CAS RN: 7249-10-7
CAS Name: 2-phenyl-1-benzopyrylium-3-ol perchlorate
OPENEYE Name: 2-phenylchromenylium-3-ol perchlorate
IUPAC Name: 2-phenylchromenylium-3-ol perchlorate
SYSTEMATIC NAME: 2-phenylchromenylium-3-ol perchlorate
MOLECULAR FORMULA: C15H11ClO6
MOLECULAR WEIGHT: 322.69724
SMILES: C1=CC=C(C=C1)C2=[O+]C3=CC=CC=C3C=C2O.[O-]Cl(=O)(=O)=O
Structure:
CAS RN: 6948-26-1
CAS Name: 2-amino-5-hydroxy-1-cyclohexanecarboxylic acid chloride
OPENEYE Name: 2-amino-5-hydroxy-cyclohexanecarboxylic acid chloride
IUPAC Name: 2-amino-5-hydroxycyclohexane-1-carboxylic acid chloride
SYSTEMATIC NAME: 2-azanyl-5-oxidanyl-cyclohexane-1-carboxylic acid chloride
MOLECULAR FORMULA: C7H13ClNO3-
MOLECULAR WEIGHT: 194.63602
SMILES: C1CC(C(CC1O)C(=O)O)N.[Cl-]
Structure:
CAS RN: 2076-91-7
CAS Name: carbamimidothioic acid [5-[(carbamimidoylthio)methyl]-2-thiophenyl]methyl ester chloride
OPENEYE Name: 2-[[5-(carbamimidoylsulfanylmethyl)-2-thienyl]methyl]isothiourea chloride
IUPAC Name: [5-(carbamimidoylsulfanylmethyl)thiophen-2-yl]methyl carbamimidothioate chloride
SYSTEMATIC NAME: [5-(carbamimidoylsulfanylmethyl)thiophen-2-yl]methyl carbamimidothioate chloride
MOLECULAR FORMULA: C8H12ClN4S3-
MOLECULAR WEIGHT: 295.85568
SMILES: C1=C(SC(=C1)CSC(=N)N)CSC(=N)N.[Cl-]
Structure:
CAS RN: 13987-24-1
CAS Name: copper; (6Z)-6-[(2-hydroxyethylamino)methylidene]-1-cyclohexa-2,4-dienone
OPENEYE Name: copper; (6Z)-6-[(2-hydroxyethylamino)methylene]cyclohexa-2,4-dien-1-one
IUPAC Name: copper; (6Z)-6-[(2-hydroxyethylamino)methylidene]cyclohexa-2,4-dien-1-one
SYSTEMATIC NAME: copper; (6Z)-6-[(2-hydroxyethylamino)methylidene]cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C18H22CuN2O4
MOLECULAR WEIGHT: 393.92428
SMILES: C1=C/C(=C/NCCO)/C(=O)C=C1.C1=C/C(=C/NCCO)/C(=O)C=C1.[Cu]
Structure:
CAS RN: 2192-06-5
CAS Name: 2-amino-4-thiazolone chloride
OPENEYE Name: 2-aminothiazol-4-one chloride
IUPAC Name: 2-amino-1,3-thiazol-4-one chloride
SYSTEMATIC NAME: 2-azanyl-1,3-thiazol-4-one chloride
MOLECULAR FORMULA: C3H4ClN2OS-
MOLECULAR WEIGHT: 151.59466
SMILES: C1C(=O)N=C(S1)N.[Cl-]
Structure:
CAS RN: 7252-53-1
CAS Name: cyclopropylmethanamine chloride
OPENEYE Name: cyclopropylmethanamine chloride
IUPAC Name: cyclopropylmethanamine chloride
SYSTEMATIC NAME: cyclopropylmethanamine chloride
MOLECULAR FORMULA: C4H9ClN-
MOLECULAR WEIGHT: 106.57396
SMILES: C1CC1CN.[Cl-]
Structure:
CAS RN: 6623-57-0
CAS Name: 2-(1,3-benzothiazol-3-ium-3-yl)-1-(3,4-dihydroxyphenyl)ethanone chloride
OPENEYE Name: 2-(1,3-benzothiazol-3-ium-3-yl)-1-(3,4-dihydroxyphenyl)ethanone chloride
IUPAC Name: 2-(1,3-benzothiazol-3-ium-3-yl)-1-(3,4-dihydroxyphenyl)ethanone chloride
SYSTEMATIC NAME: 2-(1,3-benzothiazol-3-ium-3-yl)-1-[3,4-bis(oxidanyl)phenyl]ethanone chloride
MOLECULAR FORMULA: C15H12ClNO3S
MOLECULAR WEIGHT: 321.77868
SMILES: C1=CC=C2C(=C1)[N+](=CS2)CC(=O)C3=CC(=C(C=C3)O)O.[Cl-]
Structure:
CAS RN: 6623-56-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C14H19ClN4O3
MOLECULAR WEIGHT: 326.77866
SMILES: C1N2CN3CN1C[N+](C2)(C3)CC(=O)C4=CC(=C(C=C4)O)O.[Cl-]
Structure:
CAS RN: 10535-04-3
CAS Name: 5-methoxy-1-(propan-2-ylamino)-2-pentanone hydrochloride
OPENEYE Name: 1-(isopropylamino)-5-methoxy-pentan-2-one hydrochloride
IUPAC Name: 5-methoxy-1-(propan-2-ylamino)pentan-2-one hydrochloride
SYSTEMATIC NAME: 5-methoxy-1-(propan-2-ylamino)pentan-2-one hydrochloride
MOLECULAR FORMULA: C9H20ClNO2
MOLECULAR WEIGHT: 209.7136
SMILES: CC(C)NCC(=O)CCCOC.Cl
Structure:
CAS RN: 23199-26-0
CAS Name: 2-[2-(6-aminopurin-9-yl)ethyl-(2-hydroxyethyl)amino]ethanol chloride
OPENEYE Name: 2-[2-(6-aminopurin-9-yl)ethyl-(2-hydroxyethyl)amino]ethanol chloride
IUPAC Name: 2-[2-(6-aminopurin-9-yl)ethyl-(2-hydroxyethyl)amino]ethanol chloride
SYSTEMATIC NAME: 2-[2-(6-aminopurin-9-yl)ethyl-(2-hydroxyethyl)amino]ethanol chloride
MOLECULAR FORMULA: C11H18ClN6O2-
MOLECULAR WEIGHT: 301.75262
SMILES: C1=NC2=C(C(=N1)N)N=CN2CCN(CCO)CCO.[Cl-]
Structure:
CAS RN: 6623-84-3
CAS Name: propanediimidamide chloride
OPENEYE Name: propanediamidine chloride
IUPAC Name: propanediimidamide chloride
SYSTEMATIC NAME: propanediimidamide chloride
MOLECULAR FORMULA: C3H8ClN4-
MOLECULAR WEIGHT: 135.57542
SMILES: C(C(=N)N)C(=N)N.[Cl-]
Structure:
CAS RN: 7702-10-5
CAS Name: tributyl(methoxymethyl)phosphonium chloride
OPENEYE Name: tributyl(methoxymethyl)phosphonium chloride
IUPAC Name: tributyl(methoxymethyl)phosphanium chloride
SYSTEMATIC NAME: tributyl(methoxymethyl)phosphanium chloride
MOLECULAR FORMULA: C14H32ClOP
MOLECULAR WEIGHT: 282.830041
SMILES: CCCC[P+](CCCC)(CCCC)COC.[Cl-]
Structure:
CAS RN: 7148-31-4
CAS Name: N-(benzenesulfonyl)carbamic acid (phenylmethyl) ester; sodium
OPENEYE Name: benzyl N-(benzenesulfonyl)carbamate; sodium
IUPAC Name: benzyl N-(benzenesulfonyl)carbamate; sodium
SYSTEMATIC NAME: (phenylmethyl) N-(phenylsulfonyl)carbamate; sodium
MOLECULAR FORMULA: C14H13NNaO4S
MOLECULAR WEIGHT: 314.31209
SMILES: C1=CC=C(C=C1)COC(=O)NS(=O)(=O)C2=CC=CC=C2.[Na]
Structure:
CAS RN: 25223-88-5
CAS Name: 3-[bis(2-chloroethyl)amino]-1-(4-methoxyphenyl)-1-propanone hydrochloride
OPENEYE Name: 3-[bis(2-chloroethyl)amino]-1-(4-methoxyphenyl)propan-1-one hydrochloride
IUPAC Name: 3-[bis(2-chloroethyl)amino]-1-(4-methoxyphenyl)propan-1-one hydrochloride
SYSTEMATIC NAME: 3-[bis(2-chloroethyl)amino]-1-(4-methoxyphenyl)propan-1-one hydrochloride
MOLECULAR FORMULA: C14H20Cl3NO2
MOLECULAR WEIGHT: 340.6731
SMILES: COC1=CC=C(C=C1)C(=O)CCN(CCCl)CCCl.Cl
Structure:
CAS RN: 7402-37-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C12H21ClN3O2-
MOLECULAR WEIGHT: 274.76704
SMILES: CC12CCC(O1)C3C2CN(C3)CC/C(=N/O)/N.[Cl-]
Structure:
CAS RN: 6622-86-2
CAS Name: 5-(4-morpholinyl)-1-(5-nitro-2-furanyl)-1-penten-3-one chloride
OPENEYE Name: 5-morpholino-1-(5-nitro-2-furyl)pent-1-en-3-one chloride
IUPAC Name: 5-morpholin-4-yl-1-(5-nitrofuran-2-yl)pent-1-en-3-one chloride
SYSTEMATIC NAME: 5-morpholin-4-yl-1-(5-nitrofuran-2-yl)pent-1-en-3-one chloride
MOLECULAR FORMULA: C13H16ClN2O5-
MOLECULAR WEIGHT: 315.72954
SMILES: C1COCCN1CCC(=O)C=CC2=CC=C(O2)[N+](=O)[O-].[Cl-]
Structure:
CAS RN: 6624-18-6
CAS Name: 2-chloro-N-(2-chloropropyl)-2,3-dihydro-1H-inden-1-amine hydrochloride
OPENEYE Name: 2-chloro-N-(2-chloropropyl)indan-1-amine hydrochloride
IUPAC Name: 2-chloro-N-(2-chloropropyl)-2,3-dihydro-1H-inden-1-amine hydrochloride
SYSTEMATIC NAME: 2-chloranyl-N-(2-chloranylpropyl)-2,3-dihydro-1H-inden-1-amine hydrochloride
MOLECULAR FORMULA: C12H16Cl3N
MOLECULAR WEIGHT: 280.62114
SMILES: CC(CNC1C(CC2=CC=CC=C12)Cl)Cl.Cl
Structure:
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