N-[3-[1-[(4-butoxyphenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]-2,6-dimethoxy-benzamide

Systemtic Name: N-[3-[1-[(4-butoxyphenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]-2,6-dimethoxy-benzamide Openeye Name: N-[3-[2-(4-butoxyanilino)-1-methyl-2-oxo-ethyl]sulfanylphenyl]-2,6-dimethoxy-benzamide CAS Name: N-[3-[[1-(4-butoxyanilino)-1-oxopropan-2-yl]thio]phenyl]-2,6-dimethoxybenzamide IUPAC Name: N-[3-[1-(4-butoxyanilino)-1-oxopropan-2-yl]sulfanylphenyl]-2,6-dimethoxybenzamide Traditional Name: N-[3-[[2-(4-butoxyanilino)-2-keto-1-methyl-ethyl]thio]phenyl]-2,6-dimethoxy-benzamide Formula: C28H32N2O5S MolecularWeight: 508.62908

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC(=O)C(C)SC2=CC=CC(=C2)NC(=O)C3=C(C=CC=C3OC)OC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC(=O)C(C)SC2=CC=CC(=C2)NC(=O)C3=C(C=CC=C3OC)OC

InChI

InChI=1S/C28H32N2O5S/c1-5-6-17-35-22-15-13-20(14-16-22)29-27(31)19(2)36-23-10-7-9-21(18-23)30-28(32)26-24(33-3)11-8-12-25(26)34-4/h7-16,18-19H,5-6,17H2,1-4H3,(H,29,31)(H,30,32)