N-(3-methylphenyl)-2-[2-[(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-ethanamide

Systemtic Name: N-(3-methylphenyl)-2-[2-[(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-ethanamide Openeye Name: 2-[2-[2-methyl-5-(1-piperidylsulfonyl)anilino]-2-oxo-ethyl]sulfanyl-N-(m-tolyl)acetamide CAS Name: N-(3-methylphenyl)-2-[[2-[2-methyl-5-(1-piperidinylsulfonyl)anilino]-2-oxoethyl]thio]acetamide IUPAC Name: N-(3-methylphenyl)-2-[2-(2-methyl-5-piperidin-1-ylsulfonylanilino)-2-oxoethyl]sulfanylacetamide Traditional Name: 2-[[2-keto-2-(2-methyl-5-piperidinosulfonyl-anilino)ethyl]thio]-N-(m-tolyl)acetamide Formula: C23H29N3O4S2 MolecularWeight: 475.62406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CSCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CSCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)C

InChI

InChI=1S/C23H29N3O4S2/c1-17-7-6-8-19(13-17)24-22(27)15-31-16-23(28)25-21-14-20(10-9-18(21)2)32(29,30)26-11-4-3-5-12-26/h6-10,13-14H,3-5,11-12,15-16H2,1-2H3,(H,24,27)(H,25,28)