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

Systemtic Name: N-[(Z)-3-[[4-[2-[(4-acetamidophenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]amino]-1-(3-methoxyphenyl)-3-oxidanylidene-prop-1-en-2-yl]benzamide Openeye Name: N-[(Z)-1-[[4-[2-(4-acetamidoanilino)-2-oxo-ethyl]sulfanylphenyl]carbamoyl]-2-(3-methoxyphenyl)vinyl]benzamide CAS Name: N-[(Z)-3-[4-[[2-(4-acetamidoanilino)-2-oxoethyl]thio]anilino]-1-(3-methoxyphenyl)-3-oxoprop-1-en-2-yl]benzamide IUPAC Name: N-[(Z)-3-[4-[2-(4-acetamidoanilino)-2-oxoethyl]sulfanylanilino]-1-(3-methoxyphenyl)-3-oxoprop-1-en-2-yl]benzamide Traditional Name: N-[(Z)-1-[[4-[[2-(4-acetamidoanilino)-2-keto-ethyl]thio]phenyl]carbamoyl]-2-(3-methoxyphenyl)vinyl]benzamide Formula: C33H30N4O5S MolecularWeight: 594.6801

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)CSC2=CC=C(C=C2)NC(=O)C(=CC3=CC(=CC=C3)OC)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)CSC2=CC=C(C=C2)NC(=O)/C(=C/C3=CC(=CC=C3)OC)/NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C33H30N4O5S/c1-22(38)34-25-11-13-26(14-12-25)35-31(39)21-43-29-17-15-27(16-18-29)36-33(41)30(20-23-7-6-10-28(19-23)42-2)37-32(40)24-8-4-3-5-9-24/h3-20H,21H2,1-2H3,(H,34,38)(H,35,39)(H,36,41)(H,37,40)/b30-20-