N-[4-(2-cyanopropan-2-yl)phenyl]-2-[2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-benzamide

Systemtic Name: N-[4-(2-cyanopropan-2-yl)phenyl]-2-[2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-benzamide Openeye Name: N-[4-(1-cyano-1-methyl-ethyl)phenyl]-2-[2-(3-methoxyanilino)-2-oxo-ethyl]sulfanyl-benzamide CAS Name: N-[4-(2-cyanopropan-2-yl)phenyl]-2-[[2-(3-methoxyanilino)-2-oxoethyl]thio]benzamide IUPAC Name: N-[4-(2-cyanopropan-2-yl)phenyl]-2-[2-(3-methoxyanilino)-2-oxoethyl]sulfanylbenzamide Traditional Name: N-[4-(1-cyano-1-methyl-ethyl)phenyl]-2-[[2-keto-2-(m-anisidino)ethyl]thio]benzamide Formula: C26H25N3O3S MolecularWeight: 459.56

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#N)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2SCC(=O)NC3=CC(=CC=C3)OC

Isomeric SMILES

CC(C)(C#N)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2SCC(=O)NC3=CC(=CC=C3)OC

InChI

InChI=1S/C26H25N3O3S/c1-26(2,17-27)18-11-13-19(14-12-18)29-25(31)22-9-4-5-10-23(22)33-16-24(30)28-20-7-6-8-21(15-20)32-3/h4-15H,16H2,1-3H3,(H,28,30)(H,29,31)