N-[(Z)-3-[[4-[2-[(2,4-dimethoxyphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]amino]-1-(2-methoxyphenyl)-3-oxidanylidene-prop-1-en-2-yl]benzamide

Systemtic Name: N-[(Z)-3-[[4-[2-[(2,4-dimethoxyphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]amino]-1-(2-methoxyphenyl)-3-oxidanylidene-prop-1-en-2-yl]benzamide Openeye Name: N-[(Z)-1-[[4-[2-(2,4-dimethoxyanilino)-2-oxo-1-phenyl-ethyl]sulfanylphenyl]carbamoyl]-2-(2-methoxyphenyl)vinyl]benzamide CAS Name: N-[(Z)-3-[4-[[2-(2,4-dimethoxyanilino)-2-oxo-1-phenylethyl]thio]anilino]-1-(2-methoxyphenyl)-3-oxoprop-1-en-2-yl]benzamide IUPAC Name: N-[(Z)-3-[4-[2-(2,4-dimethoxyanilino)-2-oxo-1-phenylethyl]sulfanylanilino]-1-(2-methoxyphenyl)-3-oxoprop-1-en-2-yl]benzamide Traditional Name: N-[(Z)-1-[[4-[[2-(2,4-dimethoxyanilino)-2-keto-1-phenyl-ethyl]thio]phenyl]carbamoyl]-2-(2-methoxyphenyl)vinyl]benzamide Formula: C39H35N3O6S MolecularWeight: 673.7767

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)C(C2=CC=CC=C2)SC3=CC=C(C=C3)NC(=O)C(=CC4=CC=CC=C4OC)NC(=O)C5=CC=CC=C5)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)C(C2=CC=CC=C2)SC3=CC=C(C=C3)NC(=O)/C(=C/C4=CC=CC=C4OC)/NC(=O)C5=CC=CC=C5)OC

InChI

InChI=1S/C39H35N3O6S/c1-46-30-20-23-32(35(25-30)48-3)41-39(45)36(26-12-6-4-7-13-26)49-31-21-18-29(19-22-31)40-38(44)33(24-28-16-10-11-17-34(28)47-2)42-37(43)27-14-8-5-9-15-27/h4-25,36H,1-3H3,(H,40,44)(H,41,45)(H,42,43)/b33-24-