N-[(Z)-3-[[4-[2-[(4-acetamidophenyl)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-[(4-acetamidophenyl)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-(4-acetamidoanilino)-2-oxo-1-phenyl-ethyl]sulfanylphenyl]carbamoyl]-2-(2-methoxyphenyl)vinyl]benzamide CAS Name: N-[(Z)-3-[4-[[2-(4-acetamidoanilino)-2-oxo-1-phenylethyl]thio]anilino]-1-(2-methoxyphenyl)-3-oxoprop-1-en-2-yl]benzamide IUPAC Name: N-[(Z)-3-[4-[2-(4-acetamidoanilino)-2-oxo-1-phenylethyl]sulfanylanilino]-1-(2-methoxyphenyl)-3-oxoprop-1-en-2-yl]benzamide Traditional Name: N-[(Z)-1-[[4-[[2-(4-acetamidoanilino)-2-keto-1-phenyl-ethyl]thio]phenyl]carbamoyl]-2-(2-methoxyphenyl)vinyl]benzamide Formula: C39H34N4O5S MolecularWeight: 670.77606

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=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

Isomeric SMILES

CC(=O)NC1=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

InChI

InChI=1S/C39H34N4O5S/c1-26(44)40-30-17-19-31(20-18-30)42-39(47)36(27-11-5-3-6-12-27)49-33-23-21-32(22-24-33)41-38(46)34(25-29-15-9-10-16-35(29)48-2)43-37(45)28-13-7-4-8-14-28/h3-25,36H,1-2H3,(H,40,44)(H,41,46)(H,42,47)(H,43,45)/b34-25-