N-[3-[2-[(4-butoxyphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]thiophene-2-carboxamide

Systemtic Name: N-[3-[2-[(4-butoxyphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]thiophene-2-carboxamide Openeye Name: N-[3-[2-(4-butoxyanilino)-2-oxo-1-phenyl-ethyl]sulfanylphenyl]thiophene-2-carboxamide CAS Name: N-[3-[[2-(4-butoxyanilino)-2-oxo-1-phenylethyl]thio]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[3-[2-(4-butoxyanilino)-2-oxo-1-phenylethyl]sulfanylphenyl]thiophene-2-carboxamide Traditional Name: N-[3-[[2-(4-butoxyanilino)-2-keto-1-phenyl-ethyl]thio]phenyl]thiophene-2-carboxamide Formula: C29H28N2O3S2 MolecularWeight: 516.67422

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC(=O)C(C2=CC=CC=C2)SC3=CC=CC(=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC(=O)C(C2=CC=CC=C2)SC3=CC=CC(=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C29H28N2O3S2/c1-2-3-18-34-24-16-14-22(15-17-24)30-29(33)27(21-9-5-4-6-10-21)36-25-12-7-11-23(20-25)31-28(32)26-13-8-19-35-26/h4-17,19-20,27H,2-3,18H2,1H3,(H,30,33)(H,31,32)