N-[(Z)-3-[[4-[2-[[2,5-bis(chloranyl)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-[[2,5-bis(chloranyl)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-(2,5-dichloroanilino)-2-oxo-1-phenyl-ethyl]sulfanylphenyl]carbamoyl]-2-(3-methoxyphenyl)vinyl]benzamide CAS Name: N-[(Z)-3-[4-[[2-(2,5-dichloroanilino)-2-oxo-1-phenylethyl]thio]anilino]-1-(3-methoxyphenyl)-3-oxoprop-1-en-2-yl]benzamide IUPAC Name: N-[(Z)-3-[4-[2-(2,5-dichloroanilino)-2-oxo-1-phenylethyl]sulfanylanilino]-1-(3-methoxyphenyl)-3-oxoprop-1-en-2-yl]benzamide Traditional Name: N-[(Z)-1-[[4-[[2-(2,5-dichloroanilino)-2-keto-1-phenyl-ethyl]thio]phenyl]carbamoyl]-2-(3-methoxyphenyl)vinyl]benzamide Formula: C37H29Cl2N3O4S MolecularWeight: 682.61486

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C=C(C(=O)NC2=CC=C(C=C2)SC(C3=CC=CC=C3)C(=O)NC4=C(C=CC(=C4)Cl)Cl)NC(=O)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC(=C1)/C=C(/C(=O)NC2=CC=C(C=C2)SC(C3=CC=CC=C3)C(=O)NC4=C(C=CC(=C4)Cl)Cl)\NC(=O)C5=CC=CC=C5

InChI

InChI=1S/C37H29Cl2N3O4S/c1-46-29-14-8-9-24(21-29)22-33(42-35(43)26-12-6-3-7-13-26)36(44)40-28-16-18-30(19-17-28)47-34(25-10-4-2-5-11-25)37(45)41-32-23-27(38)15-20-31(32)39/h2-23,34H,1H3,(H,40,44)(H,41,45)(H,42,43)/b33-22-