CAS RN: 21883-07-8
CAS Name: N-[(2-methoxy-1-cyclohexa-1,4-dienyl)methyl]-7H-purin-6-amine
OPENEYE Name: N-[(2-methoxycyclohexa-1,4-dien-1-yl)methyl]-7H-purin-6-amine
IUPAC Name: N-[(2-methoxycyclohexa-1,4-dien-1-yl)methyl]-7H-purin-6-amine
SYSTEMATIC NAME: N-[(2-methoxycyclohexa-1,4-dien-1-yl)methyl]-7H-purin-6-amine
MOLECULAR FORMULA: C13H15N5O
MOLECULAR WEIGHT: 257.2911
SMILES: COC1=C(CC=CC1)CNC2=NC=NC3=C2NC=N3
Structure:
CAS RN: 6623-77-4
CAS Name: 1-[(2,4-dichlorophenyl)methylideneamino]-3-heptylthiourea
OPENEYE Name: 1-[(2,4-dichlorophenyl)methyleneamino]-3-heptyl-thiourea
IUPAC Name: 1-[(2,4-dichlorophenyl)methylideneamino]-3-heptylthiourea
SYSTEMATIC NAME: 1-[(2,4-dichlorophenyl)methylideneamino]-3-heptyl-thiourea
MOLECULAR FORMULA: C15H21Cl2N3S
MOLECULAR WEIGHT: 346.31834
SMILES: CCCCCCCNC(=S)NN=CC1=C(C=C(C=C1)Cl)Cl
Structure:
CAS RN: 30101-85-0
CAS Name: 6-(2-azido-5-bromophenyl)-1,3,5-triazine-2,4-diamine
OPENEYE Name: 6-(2-azido-5-bromo-phenyl)-1,3,5-triazine-2,4-diamine
IUPAC Name: 6-(2-azido-5-bromophenyl)-1,3,5-triazine-2,4-diamine
SYSTEMATIC NAME: 6-(2-azido-5-bromanyl-phenyl)-1,3,5-triazine-2,4-diamine
MOLECULAR FORMULA: C9H7BrN8
MOLECULAR WEIGHT: 307.10948
SMILES: C1=CC(=C(C=C1Br)C2=NC(=NC(=N2)N)N)N=[N+]=[N-]
Structure:
CAS RN: 91141-73-0
CAS Name: 2-(7H-purin-6-ylthio)butanedioic acid diethyl ester
OPENEYE Name: diethyl 2-(7H-purin-6-ylsulfanyl)butanedioate
IUPAC Name: diethyl 2-(7H-purin-6-ylsulfanyl)butanedioate
SYSTEMATIC NAME: diethyl 2-(7H-purin-6-ylsulfanyl)butanedioate
MOLECULAR FORMULA: C13H16N4O4S
MOLECULAR WEIGHT: 324.35554
SMILES: CCOC(=O)CC(C(=O)OCC)SC1=NC=NC2=C1NC=N2
Structure:
CAS RN: 87170-66-9
CAS Name: 1-(2-adamantyl)-3-butylthiourea
OPENEYE Name: 1-(2-adamantyl)-3-butyl-thiourea
IUPAC Name: 1-(2-adamantyl)-3-butylthiourea
SYSTEMATIC NAME: 1-(2-adamantyl)-3-butyl-thiourea
MOLECULAR FORMULA: C15H26N2S
MOLECULAR WEIGHT: 266.44534
SMILES: CCCCNC(=S)NC1C2CC3CC(C2)CC1C3
Structure:
CAS RN: 6945-26-2
CAS Name: 1-[(3,4-dimethoxyphenyl)methylideneamino]-3-heptylthiourea
OPENEYE Name: 1-[(3,4-dimethoxyphenyl)methyleneamino]-3-heptyl-thiourea
IUPAC Name: 1-[(3,4-dimethoxyphenyl)methylideneamino]-3-heptylthiourea
SYSTEMATIC NAME: 1-[(3,4-dimethoxyphenyl)methylideneamino]-3-heptyl-thiourea
MOLECULAR FORMULA: C17H27N3O2S
MOLECULAR WEIGHT: 337.48018
SMILES: CCCCCCCNC(=S)NN=CC1=CC(=C(C=C1)OC)OC
Structure:
CAS RN: 6945-22-8
CAS Name: 1-(2-methylpropyl)-3-(1-thiophen-2-ylethylideneamino)thiourea
OPENEYE Name: 1-isobutyl-3-[1-(2-thienyl)ethylideneamino]thiourea
IUPAC Name: 1-(2-methylpropyl)-3-(1-thiophen-2-ylethylideneamino)thiourea
SYSTEMATIC NAME: 1-(2-methylpropyl)-3-(1-thiophen-2-ylethylideneamino)thiourea
MOLECULAR FORMULA: C11H17N3S2
MOLECULAR WEIGHT: 255.40278
SMILES: CC(C)CNC(=S)NN=C(C)C1=CC=CS1
Structure:
CAS RN: 13925-29-6
CAS Name: 1-(4-sulfanylidene-5,7-dihydro-1H-pyrrolo[3,4-d]pyrimidin-6-yl)ethanone
OPENEYE Name: 1-(4-thioxo-5,7-dihydro-1H-pyrrolo[3,4-d]pyrimidin-6-yl)ethanone
IUPAC Name: 1-(4-sulfanylidene-5,7-dihydro-1H-pyrrolo[3,4-d]pyrimidin-6-yl)ethanone
SYSTEMATIC NAME: 1-(4-sulfanylidene-5,7-dihydro-1H-pyrrolo[3,4-d]pyrimidin-6-yl)ethanone
MOLECULAR FORMULA: C8H9N3OS
MOLECULAR WEIGHT: 195.24156
SMILES: CC(=O)N1CC2=C(C1)NC=NC2=S
Structure:
CAS RN: 13037-52-0
CAS Name: 2-[[(2-pyridinylamino)-sulfanylidenemethyl]thio]acetic acid
OPENEYE Name: 2-(2-pyridylcarbamothioylsulfanyl)acetic acid
IUPAC Name: 2-(pyridin-2-ylcarbamothioylsulfanyl)acetic acid
SYSTEMATIC NAME: 2-(pyridin-2-ylcarbamothioylsulfanyl)ethanoic acid
MOLECULAR FORMULA: C8H8N2O2S2
MOLECULAR WEIGHT: 228.29132
SMILES: C1=CC=NC(=C1)NC(=S)SCC(=O)O
Structure:
CAS RN: 67978-99-8
CAS Name: N-ethylcarbamothioic acid O-[[17-(5-ethyl-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]] ester
OPENEYE Name: O-[[17-(4-ethyl-1,5-dimethyl-hexyl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]] N-ethylcarbamothioate
IUPAC Name: O-[[17-(5-ethyl-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]] N-ethylcarbamothioate
SYSTEMATIC NAME: O-[[17-(5-ethyl-6-methyl-heptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]] N-ethylcarbamothioate
MOLECULAR FORMULA: C32H55NOS
MOLECULAR WEIGHT: 501.8502
SMILES: CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=S)NCC)C)C)C(C)C
Structure:
CAS RN: 28937-20-4
CAS Name: N-(2-methyl-1-pyridin-1-iumyl)-N'-phenylcarbamimidothioate
OPENEYE Name: N-(2-methylpyridin-1-ium-1-yl)-N'-phenyl-carbamimidothioate
IUPAC Name: N-(2-methylpyridin-1-ium-1-yl)-N'-phenylcarbamimidothioate
SYSTEMATIC NAME: N-(2-methylpyridin-1-ium-1-yl)-N'-phenyl-carbamimidothioate
MOLECULAR FORMULA: C13H13N3S
MOLECULAR WEIGHT: 243.32742
SMILES: CC1=CC=CC=[N+]1NC(=NC2=CC=CC=C2)[S-]
Structure:
CAS RN: 78797-12-3
CAS Name: 6-[(phenylhydrazinylidene)methyl]-2-pyridinecarbothioamide
OPENEYE Name: 6-[(phenylhydrazono)methyl]pyridine-2-carbothioamide
IUPAC Name: 6-[(phenylhydrazinylidene)methyl]pyridine-2-carbothioamide
SYSTEMATIC NAME: 6-[(phenylhydrazinylidene)methyl]pyridine-2-carbothioamide
MOLECULAR FORMULA: C13H12N4S
MOLECULAR WEIGHT: 256.32618
SMILES: C1=CC=C(C=C1)NN=CC2=NC(=CC=C2)C(=S)N
Structure:
CAS RN: 58554-28-2
CAS Name: N-[[[(4-bromophenyl)-sulfanylidenemethyl]amino]-oxomethyl]-2-methylbenzamide
OPENEYE Name: N-[(4-bromobenzenecarbothioyl)carbamoyl]-2-methyl-benzamide
IUPAC Name: N-[(4-bromobenzenecarbothioyl)carbamoyl]-2-methylbenzamide
SYSTEMATIC NAME: N-[(4-bromophenyl)carbothioylcarbamoyl]-2-methyl-benzamide
MOLECULAR FORMULA: C16H13BrN2O2S
MOLECULAR WEIGHT: 377.25562
SMILES: CC1=CC=CC=C1C(=O)NC(=O)NC(=S)C2=CC=C(C=C2)Br
Structure:
CAS RN: 73024-87-0
CAS Name: 2-[[4-amino-1,4-dioxo-2-[[oxo-(5-oxo-2-pyrrolidinyl)methyl]amino]butyl]amino]acetic acid
OPENEYE Name: 2-[[4-amino-4-oxo-2-[(5-oxopyrrolidine-2-carbonyl)amino]butanoyl]amino]acetic acid
IUPAC Name: 2-[[4-amino-4-oxo-2-[(5-oxopyrrolidine-2-carbonyl)amino]butanoyl]amino]acetic acid
SYSTEMATIC NAME: 2-[[4-azanyl-4-oxidanylidene-2-[(5-oxidanylidenepyrrolidin-2-yl)carbonylamino]butanoyl]amino]ethanoic acid
MOLECULAR FORMULA: C11H16N4O6
MOLECULAR WEIGHT: 300.26794
SMILES: C1CC(=O)NC1C(=O)NC(CC(=O)N)C(=O)NCC(=O)O
Structure:
CAS RN: 18670-38-7
CAS Name: 1-[[4-[[anilino(sulfanylidene)methyl]hydrazo]-1,4-dioxobutyl]amino]-3-phenylthiourea
OPENEYE Name: 1-[[4-oxo-4-[2-(phenylcarbamothioyl)hydrazino]butanoyl]amino]-3-phenyl-thiourea
IUPAC Name: 1-[[4-oxo-4-[2-(phenylcarbamothioyl)hydrazinyl]butanoyl]amino]-3-phenylthiourea
SYSTEMATIC NAME: 1-[[4-oxidanylidene-4-[2-(phenylcarbamothioyl)hydrazinyl]butanoyl]amino]-3-phenyl-thiourea
MOLECULAR FORMULA: C18H20N6O2S2
MOLECULAR WEIGHT: 416.5204
SMILES: C1=CC=C(C=C1)NC(=S)NNC(=O)CCC(=O)NNC(=S)NC2=CC=CC=C2
Structure:
CAS RN: 87555-66-6
CAS Name: N-[1-(1-isoquinolinyl)ethylamino]carbamodithioic acid methyl ester
OPENEYE Name: methyl N-[1-(1-isoquinolyl)ethylamino]carbamodithioate
IUPAC Name: methyl N-(1-isoquinolin-1-ylethylamino)carbamodithioate
SYSTEMATIC NAME: methyl N-(1-isoquinolin-1-ylethylamino)carbamodithioate
MOLECULAR FORMULA: C13H15N3S2
MOLECULAR WEIGHT: 277.4083
SMILES: CC(C1=NC=CC2=CC=CC=C21)NNC(=S)SC
Structure:
CAS RN: 6632-53-7
CAS Name: 3,4,5,6-tetraacetyloxy-1-diazonio-1-hexen-2-olate
OPENEYE Name: 3,4,5,6-tetraacetoxy-1-diazonio-hex-1-en-2-olate
IUPAC Name: 3,4,5,6-tetraacetyloxy-1-diazoniohex-1-en-2-olate
SYSTEMATIC NAME: 3,4,5,6-tetraacetyloxy-1-diazonio-hex-1-en-2-olate
MOLECULAR FORMULA: C14H18N2O9
MOLECULAR WEIGHT: 358.30072
SMILES: CC(=O)OCC(C(C(C(=C[N+]#N)[O-])OC(=O)C)OC(=O)C)OC(=O)C
Structure:
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