N-[4-[2-[(4-butoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]-3,4-dimethoxy-benzamide

Systemtic Name: N-[4-[2-[(4-butoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]-3,4-dimethoxy-benzamide Openeye Name: N-[4-[2-(4-butoxyanilino)-2-oxo-ethyl]sulfanylphenyl]-3,4-dimethoxy-benzamide CAS Name: N-[4-[[2-(4-butoxyanilino)-2-oxoethyl]thio]phenyl]-3,4-dimethoxybenzamide IUPAC Name: N-[4-[2-(4-butoxyanilino)-2-oxoethyl]sulfanylphenyl]-3,4-dimethoxybenzamide Traditional Name: N-[4-[[2-(4-butoxyanilino)-2-keto-ethyl]thio]phenyl]-3,4-dimethoxy-benzamide Formula: C27H30N2O5S MolecularWeight: 494.6025

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC(=O)CSC2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC(=O)CSC2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C27H30N2O5S/c1-4-5-16-34-22-11-7-20(8-12-22)28-26(30)18-35-23-13-9-21(10-14-23)29-27(31)19-6-15-24(32-2)25(17-19)33-3/h6-15,17H,4-5,16,18H2,1-3H3,(H,28,30)(H,29,31)