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

Systemtic Name: N-[(Z)-3-[[4-[1-[(2-ethyl-6-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]amino]-3-oxidanylidene-1-(4-phenylphenyl)prop-1-en-2-yl]benzamide Openeye Name: N-[(Z)-1-[[4-[2-(2-ethyl-6-methyl-anilino)-1-methyl-2-oxo-ethyl]sulfanylphenyl]carbamoyl]-2-(4-phenylphenyl)vinyl]benzamide CAS Name: N-[(Z)-3-[4-[[1-(2-ethyl-6-methylanilino)-1-oxopropan-2-yl]thio]anilino]-3-oxo-1-(4-phenylphenyl)prop-1-en-2-yl]benzamide IUPAC Name: N-[(Z)-3-[4-[1-(2-ethyl-6-methylanilino)-1-oxopropan-2-yl]sulfanylanilino]-3-oxo-1-(4-phenylphenyl)prop-1-en-2-yl]benzamide Traditional Name: N-[(Z)-1-[[4-[[2-(2-ethyl-6-methyl-anilino)-2-keto-1-methyl-ethyl]thio]phenyl]carbamoyl]-2-(4-phenylphenyl)vinyl]benzamide Formula: C40H37N3O3S MolecularWeight: 639.80508

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C(C)SC2=CC=C(C=C2)NC(=O)C(=CC3=CC=C(C=C3)C4=CC=CC=C4)NC(=O)C5=CC=CC=C5)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C(C)SC2=CC=C(C=C2)NC(=O)/C(=C/C3=CC=C(C=C3)C4=CC=CC=C4)/NC(=O)C5=CC=CC=C5)C

InChI

InChI=1S/C40H37N3O3S/c1-4-30-17-11-12-27(2)37(30)43-38(44)28(3)47-35-24-22-34(23-25-35)41-40(46)36(42-39(45)33-15-9-6-10-16-33)26-29-18-20-32(21-19-29)31-13-7-5-8-14-31/h5-26,28H,4H2,1-3H3,(H,41,46)(H,42,45)(H,43,44)/b36-26-