N-[3-[1-[(4-ethoxyphenyl)amino]-1-oxidanylidene-butan-2-yl]sulfanylphenyl]-3,4-dimethoxy-benzamide

Systemtic Name: N-[3-[1-[(4-ethoxyphenyl)amino]-1-oxidanylidene-butan-2-yl]sulfanylphenyl]-3,4-dimethoxy-benzamide Openeye Name: N-[3-[1-[(4-ethoxyphenyl)carbamoyl]propylsulfanyl]phenyl]-3,4-dimethoxy-benzamide CAS Name: N-[3-[[1-(4-ethoxyanilino)-1-oxobutan-2-yl]thio]phenyl]-3,4-dimethoxybenzamide IUPAC Name: N-[3-[1-(4-ethoxyanilino)-1-oxobutan-2-yl]sulfanylphenyl]-3,4-dimethoxybenzamide Traditional Name: 3,4-dimethoxy-N-[3-[1-(p-phenetylcarbamoyl)propylthio]phenyl]benzamide Formula: C27H30N2O5S MolecularWeight: 494.6025

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)OCC)SC2=CC=CC(=C2)NC(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)OCC)SC2=CC=CC(=C2)NC(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C27H30N2O5S/c1-5-25(27(31)28-19-11-13-21(14-12-19)34-6-2)35-22-9-7-8-20(17-22)29-26(30)18-10-15-23(32-3)24(16-18)33-4/h7-17,25H,5-6H2,1-4H3,(H,28,31)(H,29,30)