N-[(Z)-3-[[4-[2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]amino]-1-(3-methoxyphenyl)-3-oxidanylidene-prop-1-en-2-yl]benzamide

Systemtic Name: N-[(Z)-3-[[4-[2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]amino]-1-(3-methoxyphenyl)-3-oxidanylidene-prop-1-en-2-yl]benzamide Openeye Name: N-[(Z)-1-[[4-[2-(2-ethyl-6-methyl-anilino)-2-oxo-1-phenyl-ethyl]sulfanylphenyl]carbamoyl]-2-(3-methoxyphenyl)vinyl]benzamide CAS Name: N-[(Z)-3-[4-[[2-(2-ethyl-6-methylanilino)-2-oxo-1-phenylethyl]thio]anilino]-1-(3-methoxyphenyl)-3-oxoprop-1-en-2-yl]benzamide IUPAC Name: N-[(Z)-3-[4-[2-(2-ethyl-6-methylanilino)-2-oxo-1-phenylethyl]sulfanylanilino]-1-(3-methoxyphenyl)-3-oxoprop-1-en-2-yl]benzamide Traditional Name: N-[(Z)-1-[[4-[[2-(2-ethyl-6-methyl-anilino)-2-keto-1-phenyl-ethyl]thio]phenyl]carbamoyl]-2-(3-methoxyphenyl)vinyl]benzamide Formula: C40H37N3O4S MolecularWeight: 655.80448

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C(C2=CC=CC=C2)SC3=CC=C(C=C3)NC(=O)C(=CC4=CC(=CC=C4)OC)NC(=O)C5=CC=CC=C5)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C(C2=CC=CC=C2)SC3=CC=C(C=C3)NC(=O)/C(=C/C4=CC(=CC=C4)OC)/NC(=O)C5=CC=CC=C5)C

InChI

InChI=1S/C40H37N3O4S/c1-4-29-19-11-13-27(2)36(29)43-40(46)37(30-15-7-5-8-16-30)48-34-23-21-32(22-24-34)41-39(45)35(26-28-14-12-20-33(25-28)47-3)42-38(44)31-17-9-6-10-18-31/h5-26,37H,4H2,1-3H3,(H,41,45)(H,42,44)(H,43,46)/b35-26-