methyl 2-[[(2-phenyl-2-phenylsulfanyl-ethanoyl)amino]carbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Systemtic Name: methyl 2-[[(2-phenyl-2-phenylsulfanyl-ethanoyl)amino]carbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Openeye Name: methyl 2-[[(2-phenyl-2-phenylsulfanyl-acetyl)amino]carbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate CAS Name: 2-[[[[1-oxo-2-phenyl-2-(phenylthio)ethyl]hydrazo]-sulfanylidenemethyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[[(2-phenyl-2-phenylsulfanylacetyl)amino]carbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Traditional Name: 2-[[[2-phenyl-2-(phenylthio)acetyl]amino]thiocarbamoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester Formula: C24H23N3O3S3 MolecularWeight: 497.65272

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC2=C1CCC2)NC(=S)NNC(=O)C(C3=CC=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=C(SC2=C1CCC2)NC(=S)NNC(=O)C(C3=CC=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C24H23N3O3S3/c1-30-23(29)19-17-13-8-14-18(17)33-22(19)25-24(31)27-26-21(28)20(15-9-4-2-5-10-15)32-16-11-6-3-7-12-16/h2-7,9-12,20H,8,13-14H2,1H3,(H,26,28)(H2,25,27,31)