methyl 4-phenyl-2-[(2-phenyl-2-phenylsulfanyl-ethanoyl)amino]thiophene-3-carboxylate

Systemtic Name: methyl 4-phenyl-2-[(2-phenyl-2-phenylsulfanyl-ethanoyl)amino]thiophene-3-carboxylate Openeye Name: methyl 4-phenyl-2-[(2-phenyl-2-phenylsulfanyl-acetyl)amino]thiophene-3-carboxylate CAS Name: 2-[[1-oxo-2-phenyl-2-(phenylthio)ethyl]amino]-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-phenyl-2-[(2-phenyl-2-phenylsulfanylacetyl)amino]thiophene-3-carboxylate Traditional Name: 4-phenyl-2-[[2-phenyl-2-(phenylthio)acetyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C26H21NO3S2 MolecularWeight: 459.57984

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C(C3=CC=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C(C3=CC=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C26H21NO3S2/c1-30-26(29)22-21(18-11-5-2-6-12-18)17-31-25(22)27-24(28)23(19-13-7-3-8-14-19)32-20-15-9-4-10-16-20/h2-17,23H,1H3,(H,27,28)