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

Systemtic Name: methyl 4-(4-methylphenyl)-2-[(2-phenyl-2-phenylsulfanyl-ethanoyl)amino]thiophene-3-carboxylate Openeye Name: methyl 2-[(2-phenyl-2-phenylsulfanyl-acetyl)amino]-4-(p-tolyl)thiophene-3-carboxylate CAS Name: 4-(4-methylphenyl)-2-[[1-oxo-2-phenyl-2-(phenylthio)ethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-methylphenyl)-2-[(2-phenyl-2-phenylsulfanylacetyl)amino]thiophene-3-carboxylate Traditional Name: 2-[[2-phenyl-2-(phenylthio)acetyl]amino]-4-(p-tolyl)thiophene-3-carboxylic acid methyl ester Formula: C27H23NO3S2 MolecularWeight: 473.60642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)C(C3=CC=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)C(C3=CC=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C27H23NO3S2/c1-18-13-15-19(16-14-18)22-17-32-26(23(22)27(30)31-2)28-25(29)24(20-9-5-3-6-10-20)33-21-11-7-4-8-12-21/h3-17,24H,1-2H3,(H,28,29)