CAS RN: 57223-75-3
CAS Name: 2-[[(4-chloroanilino)-sulfanylidenemethyl]thio]propanoic acid
OPENEYE Name: 2-[(4-chlorophenyl)carbamothioylsulfanyl]propanoic acid
IUPAC Name: 2-[(4-chlorophenyl)carbamothioylsulfanyl]propanoic acid
SYSTEMATIC NAME: 2-[(4-chlorophenyl)carbamothioylsulfanyl]propanoic acid
MOLECULAR FORMULA: C10H10ClNO2S2
MOLECULAR WEIGHT: 275.7749
SMILES: CC(C(=O)O)SC(=S)NC1=CC=C(C=C1)Cl
Structure:
CAS RN: 23939-19-7
CAS Name: 6-(1-adamantyl)-2-sulfanylidene-1H-pyrimidin-4-one
OPENEYE Name: 6-(1-adamantyl)-2-thioxo-1H-pyrimidin-4-one
IUPAC Name: 6-(1-adamantyl)-2-sulfanylidene-1H-pyrimidin-4-one
SYSTEMATIC NAME: 6-(1-adamantyl)-2-sulfanylidene-1H-pyrimidin-4-one
MOLECULAR FORMULA: C14H18N2OS
MOLECULAR WEIGHT: 262.37052
SMILES: C1C2CC3CC1CC(C2)(C3)C4=CC(=O)NC(=S)N4
Structure:
CAS RN: 7249-71-0
CAS Name: 2,6-bis(sulfanylidene)-1,3-diazinan-4-one
OPENEYE Name: 2,6-dithioxohexahydropyrimidin-4-one
IUPAC Name: 2,6-bis(sulfanylidene)-1,3-diazinan-4-one
SYSTEMATIC NAME: 2,6-bis(sulfanylidene)-1,3-diazinan-4-one
MOLECULAR FORMULA: C4H4N2OS2
MOLECULAR WEIGHT: 160.21736
SMILES: C1C(=O)NC(=S)NC1=S
Structure:
CAS RN: 15088-64-9
CAS Name: 2-diazonio-1-[(2-ethoxy-2-oxoethyl)amino]-3-oxo-4-phenoxy-1-buten-1-olate
OPENEYE Name: 2-diazonio-1-[(2-ethoxy-2-oxo-ethyl)amino]-3-oxo-4-phenoxy-but-1-en-1-olate
IUPAC Name: 2-diazonio-1-[(2-ethoxy-2-oxoethyl)amino]-3-oxo-4-phenoxybut-1-en-1-olate
SYSTEMATIC NAME: 2-diazonio-1-[(2-ethoxy-2-oxidanylidene-ethyl)amino]-3-oxidanylidene-4-phenoxy-but-1-en-1-olate
MOLECULAR FORMULA: C14H15N3O5
MOLECULAR WEIGHT: 305.286
SMILES: CCOC(=O)CNC(=C(C(=O)COC1=CC=CC=C1)[N+]#N)[O-]
Structure:
CAS RN: 17005-43-5
CAS Name: 2-amino-6-methyl-5-(3-methylbutyl)-1H-pyrimidine-4-thione
OPENEYE Name: 2-amino-5-isopentyl-6-methyl-1H-pyrimidine-4-thione
IUPAC Name: 2-amino-6-methyl-5-(3-methylbutyl)-1H-pyrimidine-4-thione
SYSTEMATIC NAME: 2-azanyl-6-methyl-5-(3-methylbutyl)-1H-pyrimidine-4-thione
MOLECULAR FORMULA: C10H17N3S
MOLECULAR WEIGHT: 211.32708
SMILES: CC1=C(C(=S)N=C(N1)N)CCC(C)C
Structure:
CAS RN: 13458-60-1
CAS Name: 2-[4-(dimethylamino)phenyl]-4-(4-dimethyliminio-1-cyclohexa-2,5-dienylidene)-3-oxo-1-cyclobutenolate
OPENEYE Name: 2-[4-(dimethylamino)phenyl]-4-(4-dimethyliminiocyclohexa-2,5-dien-1-ylidene)-3-oxo-cyclobuten-1-olate
IUPAC Name: 2-[4-(dimethylamino)phenyl]-4-(4-dimethylazaniumylidenecyclohexa-2,5-dien-1-ylidene)-3-oxocyclobuten-1-olate
SYSTEMATIC NAME: 2-[4-(dimethylamino)phenyl]-4-(4-dimethylazaniumylidenecyclohexa-2,5-dien-1-ylidene)-3-oxidanylidene-cyclobuten-1-olate
MOLECULAR FORMULA: C20H20N2O2
MOLECULAR WEIGHT: 320.385
SMILES: CN(C)C1=CC=C(C=C1)C2=C(C(=C3C=CC(=[N+](C)C)C=C3)C2=O)[O-]
Structure:
CAS RN: 15411-43-5
CAS Name: 3-ethenylaniline
OPENEYE Name: 3-vinylaniline
IUPAC Name: 3-ethenylaniline
SYSTEMATIC NAME: 3-ethenylaniline
MOLECULAR FORMULA: C8H9N
MOLECULAR WEIGHT: 119.16376
SMILES: C=CC1=CC(=CC=C1)N
Structure:
CAS RN: 1986-39-6
CAS Name: 5-propan-2-yl-2-sulfanylidene-4-thiazolidinone
OPENEYE Name: 5-isopropyl-2-thioxo-thiazolidin-4-one
IUPAC Name: 5-propan-2-yl-2-sulfanylidene-1,3-thiazolidin-4-one
SYSTEMATIC NAME: 5-propan-2-yl-2-sulfanylidene-1,3-thiazolidin-4-one
MOLECULAR FORMULA: C6H9NOS2
MOLECULAR WEIGHT: 175.27176
SMILES: CC(C)C1C(=O)NC(=S)S1
Structure:
CAS RN: 13094-51-4
CAS Name: 2-bromoacetic acid (2-bromo-1-oxoethyl) ester
OPENEYE Name: (2-bromoacetyl) 2-bromoacetate
IUPAC Name: (2-bromoacetyl) 2-bromoacetate
SYSTEMATIC NAME: 2-bromanylethanoyl 2-bromanylethanoate
MOLECULAR FORMULA: C4H4Br2O3
MOLECULAR WEIGHT: 259.88076
SMILES: C(C(=O)OC(=O)CBr)Br
Structure:
CAS RN: 103343-47-1
CAS Name: 3-amino-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one
OPENEYE Name: 3-amino-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one
IUPAC Name: 3-amino-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one
SYSTEMATIC NAME: 3-azanyl-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one
MOLECULAR FORMULA: C15H13N3O
MOLECULAR WEIGHT: 251.28322
SMILES: C1=CC=C(C=C1)C2=NC(C(=O)NC3=CC=CC=C32)N
Structure:
CAS RN: 1629-19-2
CAS Name: 4-fluoro-N-phenylbenzenecarbothioamide
OPENEYE Name: 4-fluoro-N-phenyl-benzenecarbothioamide
IUPAC Name: 4-fluoro-N-phenylbenzenecarbothioamide
SYSTEMATIC NAME: 4-fluoranyl-N-phenyl-benzenecarbothioamide
MOLECULAR FORMULA: C13H10FNS
MOLECULAR WEIGHT: 231.288603
SMILES: C1=CC=C(C=C1)NC(=S)C2=CC=C(C=C2)F
Structure:
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