CAS RN: 115-08-2
CAS Name: methanethioamide
OPENEYE Name: thioformamide
IUPAC Name: methanethioamide
SYSTEMATIC NAME: methanethioamide
MOLECULAR FORMULA: CH3NS
MOLECULAR WEIGHT: 61.10622
SMILES: C(=S)N
Structure:
CAS RN: 89778-26-7
CAS Name: 2-[4-[(Z)-4-chloro-1,2-diphenylbut-1-enyl]phenoxy]-N,N-dimethylethanamine
OPENEYE Name: 2-[4-[(Z)-4-chloro-1,2-diphenyl-but-1-enyl]phenoxy]-N,N-dimethyl-ethanamine
IUPAC Name: 2-[4-[(Z)-4-chloro-1,2-diphenylbut-1-enyl]phenoxy]-N,N-dimethylethanamine
SYSTEMATIC NAME: 2-[4-[(Z)-4-chloranyl-1,2-diphenyl-but-1-enyl]phenoxy]-N,N-dimethyl-ethanamine
MOLECULAR FORMULA: C26H28ClNO
MOLECULAR WEIGHT: 405.95962
SMILES: CN(C)CCOC1=CC=C(C=C1)/C(=C(/CCCl)\C2=CC=CC=C2)/C3=CC=CC=C3
Structure:
CAS RN: 98644-21-4
CAS Name: 2-[4-[(Z)-4-chloro-1,2-diphenylbut-1-enyl]phenoxy]-N,N-dimethylethanamine
OPENEYE Name: 2-[4-[(Z)-4-chloro-1,2-diphenyl-but-1-enyl]phenoxy]-N,N-dimethyl-ethanamine
IUPAC Name: 2-[4-[(Z)-4-chloro-1,2-diphenylbut-1-enyl]phenoxy]-N,N-dimethylethanamine
SYSTEMATIC NAME: 2-[4-[(Z)-4-chloranyl-1,2-diphenyl-but-1-enyl]phenoxy]-N,N-dimethyl-ethanamine
MOLECULAR FORMULA: C26H28ClNO
MOLECULAR WEIGHT: 405.95962
SMILES: CN(C)CCOC1=CC=C(C=C1)/C(=C(/CCCl)\C2=CC=CC=C2)/C3=CC=CC=C3
Structure:
CAS RN: 89778-27-8
CAS Name: 2-[4-[(Z)-4-chloro-1,2-diphenylbut-1-enyl]phenoxy]-N,N-dimethylethanamine; 2-hydroxypropane-1,2,3-tricarboxylic acid
OPENEYE Name: 2-[4-[(Z)-4-chloro-1,2-diphenyl-but-1-enyl]phenoxy]-N,N-dimethyl-ethanamine; citric acid
IUPAC Name: 2-[4-[(Z)-4-chloro-1,2-diphenylbut-1-enyl]phenoxy]-N,N-dimethylethanamine; 2-hydroxypropane-1,2,3-tricarboxylic acid
SYSTEMATIC NAME: 2-[4-[(Z)-4-chloranyl-1,2-diphenyl-but-1-enyl]phenoxy]-N,N-dimethyl-ethanamine; 2-oxidanylpropane-1,2,3-tricarboxylic acid
MOLECULAR FORMULA: C32H36ClNO8
MOLECULAR WEIGHT: 598.08314
SMILES: CN(C)CCOC1=CC=C(C=C1)/C(=C(/CCCl)\C2=CC=CC=C2)/C3=CC=CC=C3.C(C(=O)O)C(CC(=O)O)(C(=O)O)O
Structure:
CAS RN: 94203-53-9
CAS Name: carbamimidoyl(dimethyl)ammonium; sulfuric acid [(E)-[1-[2-(3-furanyl)ethyl]-4b,8,8,10a-tetramethyl-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthren-2-ylidene]methyl] ester
OPENEYE Name: carbamimidoyl(dimethyl)ammonium; [(E)-[1-[2-(3-furyl)ethyl]-4b,8,8,10a-tetramethyl-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthren-2-ylidene]methyl] hydrogen sulfate
IUPAC Name: carbamimidoyl(dimethyl)azanium; [(E)-[1-[2-(furan-3-yl)ethyl]-4b,8,8,10a-tetramethyl-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthren-2-ylidene]methyl] hydrogen sulfate
SYSTEMATIC NAME: carbamimidoyl(dimethyl)azanium; [(E)-[1-[2-(furan-3-yl)ethyl]-4b,8,8,10a-tetramethyl-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthren-2-ylidene]methyl] hydrogen sulfate
MOLECULAR FORMULA: C28H48N3O5S+
MOLECULAR WEIGHT: 538.76282
SMILES: CC1(CCCC2(C1CCC3(C2CC/C(=C\OS(=O)(=O)O)/C3CCC4=COC=C4)C)C)C.C[NH+](C)C(=N)N
Structure:
CAS RN: 71555-47-0
CAS Name: N-[1-(2-pyridinyl)ethylideneamino]-3-azabicyclo[3.2.2]nonane-3-carbothioamide
OPENEYE Name: N-[1-(2-pyridyl)ethylideneamino]-3-azabicyclo[3.2.2]nonane-3-carbothioamide
IUPAC Name: N-(1-pyridin-2-ylethylideneamino)-3-azabicyclo[3.2.2]nonane-3-carbothioamide
SYSTEMATIC NAME: N-(1-pyridin-2-ylethylideneamino)-3-azabicyclo[3.2.2]nonane-3-carbothioamide
MOLECULAR FORMULA: C16H22N4S
MOLECULAR WEIGHT: 302.43768
SMILES: CC(=NNC(=S)N1CC2CCC(C1)CC2)C3=CC=CC=N3
Structure:
CAS RN: 13515-02-1
CAS Name: 4-amino-1H-pyrazolo[3,4-d][1,3]thiazine-6-thione
OPENEYE Name: 4-amino-1H-pyrazolo[3,4-d][1,3]thiazine-6-thione
IUPAC Name: 4-amino-1H-pyrazolo[3,4-d][1,3]thiazine-6-thione
SYSTEMATIC NAME: 4-azanyl-1H-pyrazolo[3,4-d][1,3]thiazine-6-thione
MOLECULAR FORMULA: C5H4N4S2
MOLECULAR WEIGHT: 184.24206
SMILES: C1=NNC2=NC(=S)SC(=C21)N
Structure:
CAS RN: 13515-03-2
CAS Name: 4-amino-1H-pyrazolo[3,4-d][1,3]thiazine-6-thione; pyridine
OPENEYE Name: 4-amino-1H-pyrazolo[3,4-d][1,3]thiazine-6-thione; pyridine
IUPAC Name: 4-amino-1H-pyrazolo[3,4-d][1,3]thiazine-6-thione; pyridine
SYSTEMATIC NAME: 4-azanyl-1H-pyrazolo[3,4-d][1,3]thiazine-6-thione; pyridine
MOLECULAR FORMULA: C10H9N5S2
MOLECULAR WEIGHT: 263.34196
SMILES: C1=CC=NC=C1.C1=NNC2=NC(=S)SC(=C21)N
Structure:
CAS RN: 1796-92-5
CAS Name: 5-[(E)-(3-carboxy-5-methyl-4-oxo-1-cyclohexa-2,5-dienylidene)-(2,6-dichlorophenyl)methyl]-2-hydroxy-3-methylbenzoic acid
OPENEYE Name: 5-[(E)-(3-carboxy-5-methyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)-(2,6-dichlorophenyl)methyl]-2-hydroxy-3-methyl-benzoic acid
IUPAC Name: 5-[(E)-(3-carboxy-5-methyl-4-oxocyclohexa-2,5-dien-1-ylidene)-(2,6-dichlorophenyl)methyl]-2-hydroxy-3-methylbenzoic acid
SYSTEMATIC NAME: 5-[(E)-[2,6-bis(chloranyl)phenyl]-(3-carboxy-5-methyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-3-methyl-2-oxidanyl-benzoic acid
MOLECULAR FORMULA: C23H16Cl2O6
MOLECULAR WEIGHT: 459.27554
SMILES: CC1=CC(=CC(=C1O)C(=O)O)/C(=C\2/C=C(C(=O)C(=C2)C(=O)O)C)/C3=C(C=CC=C3Cl)Cl
Structure:
CAS RN: 74051-63-1
CAS Name: 1-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-3-(4-methoxyphenyl)thiourea
OPENEYE Name: 1-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-3-(4-methoxyphenyl)thiourea
IUPAC Name: 1-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3-(4-methoxyphenyl)thiourea
SYSTEMATIC NAME: 1-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-(4-methoxyphenyl)thiourea
MOLECULAR FORMULA: C19H20N4O2S
MOLECULAR WEIGHT: 368.4527
SMILES: CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=S)NC3=CC=C(C=C3)OC
Structure:
CAS RN: 104715-68-6
CAS Name: 2-(4-butylanilino)-3,7-dihydropurine-6-thione
OPENEYE Name: 2-(4-butylanilino)-3,7-dihydropurine-6-thione
IUPAC Name: 2-(4-butylanilino)-3,7-dihydropurine-6-thione
SYSTEMATIC NAME: 2-[(4-butylphenyl)amino]-3,7-dihydropurine-6-thione
MOLECULAR FORMULA: C15H17N5S
MOLECULAR WEIGHT: 299.39398
SMILES: CCCCC1=CC=C(C=C1)NC2=NC(=S)C3=C(N2)N=CN3
Structure:
CAS RN: 618-81-5
CAS Name: 5-(2-furanylmethylidene)-2-sulfanylidene-4-imidazolidinone
OPENEYE Name: 5-(2-furylmethylene)-2-thioxo-imidazolidin-4-one
IUPAC Name: 5-(furan-2-ylmethylidene)-2-sulfanylideneimidazolidin-4-one
SYSTEMATIC NAME: 5-(furan-2-ylmethylidene)-2-sulfanylidene-imidazolidin-4-one
MOLECULAR FORMULA: C8H6N2O2S
MOLECULAR WEIGHT: 194.21044
SMILES: C1=COC(=C1)C=C2C(=O)NC(=S)N2
Structure:
CAS RN: 104715-84-6
CAS Name: 2-(4-butylanilino)-9-(2-hydroxyethoxymethyl)-3H-purine-6-thione
OPENEYE Name: 2-(4-butylanilino)-9-(2-hydroxyethoxymethyl)-3H-purine-6-thione
IUPAC Name: 2-(4-butylanilino)-9-(2-hydroxyethoxymethyl)-3H-purine-6-thione
SYSTEMATIC NAME: 2-[(4-butylphenyl)amino]-9-(2-hydroxyethyloxymethyl)-3H-purine-6-thione
MOLECULAR FORMULA: C18H23N5O2S
MOLECULAR WEIGHT: 373.47252
SMILES: CCCCC1=CC=C(C=C1)NC2=NC(=S)C3=C(N2)N(C=N3)COCCO
Structure:
CAS RN: 59150-27-5
CAS Name: 4,6-diamino-5-nitroso-1H-pyrimidine-2-thione
OPENEYE Name: 4,6-diamino-5-nitroso-1H-pyrimidine-2-thione
IUPAC Name: 4,6-diamino-5-nitroso-1H-pyrimidine-2-thione
SYSTEMATIC NAME: 4,6-bis(azanyl)-5-nitroso-1H-pyrimidine-2-thione
MOLECULAR FORMULA: C4H5N5OS
MOLECULAR WEIGHT: 171.1804
SMILES: C1(=C(NC(=S)N=C1N)N)N=O
Structure:
CAS RN: 87187-84-6
CAS Name: 1,3-bis(2-pyridinylmethylideneamino)thiourea
OPENEYE Name: 1,3-bis(2-pyridylmethyleneamino)thiourea
IUPAC Name: 1,3-bis(pyridin-2-ylmethylideneamino)thiourea
SYSTEMATIC NAME: 1,3-bis(pyridin-2-ylmethylideneamino)thiourea
MOLECULAR FORMULA: C13H12N6S
MOLECULAR WEIGHT: 284.33958
SMILES: C1=CC=NC(=C1)C=NNC(=S)NN=CC2=CC=CC=N2
Structure:
CAS RN: 152423-16-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C13H7ClN4S2
MOLECULAR WEIGHT: 318.80448
SMILES: C1=CC(=CC=C1C2=CSC3=NC4=C(C=NN4)C(=S)N23)Cl
Structure:
CAS RN: 70618-53-0
CAS Name: 1-cyclohexyl-3-[1-(2-pyridinyl)ethylideneamino]thiourea
OPENEYE Name: 1-cyclohexyl-3-[1-(2-pyridyl)ethylideneamino]thiourea
IUPAC Name: 1-cyclohexyl-3-(1-pyridin-2-ylethylideneamino)thiourea
SYSTEMATIC NAME: 1-cyclohexyl-3-(1-pyridin-2-ylethylideneamino)thiourea
MOLECULAR FORMULA: C14H20N4S
MOLECULAR WEIGHT: 276.4004
SMILES: CC(=NNC(=S)NC1CCCCC1)C2=CC=CC=N2
Structure:
CAS RN: 102339-02-6
CAS Name: 2-[[(2,2-dimethylhydrazinyl)-sulfanylidenemethyl]amino]benzoic acid methyl ester
OPENEYE Name: methyl 2-(dimethylaminocarbamothioylamino)benzoate
IUPAC Name: methyl 2-(dimethylaminocarbamothioylamino)benzoate
SYSTEMATIC NAME: methyl 2-(dimethylaminocarbamothioylamino)benzoate
MOLECULAR FORMULA: C11H15N3O2S
MOLECULAR WEIGHT: 253.3207
SMILES: CN(C)NC(=S)NC1=CC=CC=C1C(=O)OC
Structure:
CAS RN: 102433-25-0
CAS Name: 1-(2,2-dimethoxyethyl)-1-methyl-3-(1-naphthalenyl)thiourea
OPENEYE Name: 1-(2,2-dimethoxyethyl)-1-methyl-3-(1-naphthyl)thiourea
IUPAC Name: 1-(2,2-dimethoxyethyl)-1-methyl-3-naphthalen-1-ylthiourea
SYSTEMATIC NAME: 1-(2,2-dimethoxyethyl)-1-methyl-3-naphthalen-1-yl-thiourea
MOLECULAR FORMULA: C16H20N2O2S
MOLECULAR WEIGHT: 304.4072
SMILES: CN(CC(OC)OC)C(=S)NC1=CC=CC2=CC=CC=C21
Structure:
CAS RN: 102433-19-2
CAS Name: 1-(2,2-diethoxyethyl)-1-methyl-3-(1-naphthalenyl)thiourea
OPENEYE Name: 1-(2,2-diethoxyethyl)-1-methyl-3-(1-naphthyl)thiourea
IUPAC Name: 1-(2,2-diethoxyethyl)-1-methyl-3-naphthalen-1-ylthiourea
SYSTEMATIC NAME: 1-(2,2-diethoxyethyl)-1-methyl-3-naphthalen-1-yl-thiourea
MOLECULAR FORMULA: C18H24N2O2S
MOLECULAR WEIGHT: 332.46036
SMILES: CCOC(CN(C)C(=S)NC1=CC=CC2=CC=CC=C21)OCC
Structure:
CAS RN: 102339-01-5
CAS Name: 1-amino-3-[4-(diethylamino)phenyl]thiourea
OPENEYE Name: 1-amino-3-[4-(diethylamino)phenyl]thiourea
IUPAC Name: 1-amino-3-[4-(diethylamino)phenyl]thiourea
SYSTEMATIC NAME: 1-azanyl-3-[4-(diethylamino)phenyl]thiourea
MOLECULAR FORMULA: C11H18N4S
MOLECULAR WEIGHT: 238.35242
SMILES: CCN(CC)C1=CC=C(C=C1)NC(=S)NN
Structure:
CAS RN: 102339-03-7
CAS Name: 1-(dimethylamino)-3-[4-(methylthio)phenyl]thiourea
OPENEYE Name: 1-(dimethylamino)-3-(4-methylsulfanylphenyl)thiourea
IUPAC Name: 1-(dimethylamino)-3-(4-methylsulfanylphenyl)thiourea
SYSTEMATIC NAME: 1-(dimethylamino)-3-(4-methylsulfanylphenyl)thiourea
MOLECULAR FORMULA: C10H15N3S2
MOLECULAR WEIGHT: 241.3762
SMILES: CN(C)NC(=S)NC1=CC=C(C=C1)SC
Structure:
CAS RN: 552-80-7
CAS Name: 4-[(E)-3-(4-hydroxyphenyl)but-2-en-2-yl]phenol
OPENEYE Name: 4-[(E)-2-(4-hydroxyphenyl)-1-methyl-prop-1-enyl]phenol
IUPAC Name: 4-[(E)-3-(4-hydroxyphenyl)but-2-en-2-yl]phenol
SYSTEMATIC NAME: 4-[(E)-3-(4-hydroxyphenyl)but-2-en-2-yl]phenol
MOLECULAR FORMULA: C16H16O2
MOLECULAR WEIGHT: 240.29704
SMILES: C/C(=C(/C)\C1=CC=C(C=C1)O)/C2=CC=C(C=C2)O
Structure:
CAS RN: 13366-36-4
CAS Name: 4-[(E)-3-(4-hydroxyphenyl)but-2-en-2-yl]phenol
OPENEYE Name: 4-[(E)-2-(4-hydroxyphenyl)-1-methyl-prop-1-enyl]phenol
IUPAC Name: 4-[(E)-3-(4-hydroxyphenyl)but-2-en-2-yl]phenol
SYSTEMATIC NAME: 4-[(E)-3-(4-hydroxyphenyl)but-2-en-2-yl]phenol
MOLECULAR FORMULA: C16H16O2
MOLECULAR WEIGHT: 240.29704
SMILES: C/C(=C(/C)\C1=CC=C(C=C1)O)/C2=CC=C(C=C2)O
Structure:
CAS RN: 73855-60-4
CAS Name: 5-[(2-methoxyphenyl)methylidene]-2-sulfanylidene-4-thiazolidinone
OPENEYE Name: 5-[(2-methoxyphenyl)methylene]-2-thioxo-thiazolidin-4-one
IUPAC Name: 5-[(2-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
SYSTEMATIC NAME: 5-[(2-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
MOLECULAR FORMULA: C11H9NO2S2
MOLECULAR WEIGHT: 251.32466
SMILES: COC1=CC=CC=C1C=C2C(=O)NC(=S)S2
Structure:
CAS RN: 26158-47-4
CAS Name: N-[1-(2-pyridinyl)ethylideneamino]carbamodithioic acid (phenylmethyl) ester
OPENEYE Name: benzyl N-[1-(2-pyridyl)ethylideneamino]carbamodithioate
IUPAC Name: benzyl N-(1-pyridin-2-ylethylideneamino)carbamodithioate
SYSTEMATIC NAME: (phenylmethyl) N-(1-pyridin-2-ylethylideneamino)carbamodithioate
MOLECULAR FORMULA: C15H15N3S2
MOLECULAR WEIGHT: 301.4297
SMILES: CC(=NNC(=S)SCC1=CC=CC=C1)C2=CC=CC=N2
Structure:
CAS RN: 4094-44-4
CAS Name: 3-[[anilino(sulfanylidene)methyl]thio]propanoic acid
OPENEYE Name: 3-(phenylcarbamothioylsulfanyl)propanoic acid
IUPAC Name: 3-(phenylcarbamothioylsulfanyl)propanoic acid
SYSTEMATIC NAME: 3-(phenylcarbamothioylsulfanyl)propanoic acid
MOLECULAR FORMULA: C10H11NO2S2
MOLECULAR WEIGHT: 241.32984
SMILES: C1=CC=C(C=C1)NC(=S)SCCC(=O)O
Structure:
CAS RN: 92412-31-2
CAS Name: N-decylcarbamothioic acid O-methyl ester
OPENEYE Name: O-methyl N-decylcarbamothioate
IUPAC Name: O-methyl N-decylcarbamothioate
SYSTEMATIC NAME: O-methyl N-decylcarbamothioate
MOLECULAR FORMULA: C12H25NOS
MOLECULAR WEIGHT: 231.398
SMILES: CCCCCCCCCCNC(=S)OC
Structure:
CAS RN: 92412-08-3
CAS Name: N-methylcarbamothioic acid O-nonyl ester
OPENEYE Name: O-nonyl N-methylcarbamothioate
IUPAC Name: O-nonyl N-methylcarbamothioate
SYSTEMATIC NAME: O-nonyl N-methylcarbamothioate
MOLECULAR FORMULA: C11H23NOS
MOLECULAR WEIGHT: 217.37142
SMILES: CCCCCCCCCOC(=S)NC
Structure:
CAS RN: 141992-47-4
CAS Name: 1,4-dimethoxy-10H-acridine-9-thione
OPENEYE Name: 1,4-dimethoxy-10H-acridine-9-thione
IUPAC Name: 1,4-dimethoxy-10H-acridine-9-thione
SYSTEMATIC NAME: 1,4-dimethoxy-10H-acridine-9-thione
MOLECULAR FORMULA: C15H13NO2S
MOLECULAR WEIGHT: 271.33422
SMILES: COC1=C2C(=C(C=C1)OC)NC3=CC=CC=C3C2=S
Structure:
No comments:
Post a Comment