2-[(3-methylphenyl)-(phenylsulfonyl)amino]-N-[(4-piperidin-1-ylphenyl)methyl]ethanamide

Systemtic Name: 2-[(3-methylphenyl)-(phenylsulfonyl)amino]-N-[(4-piperidin-1-ylphenyl)methyl]ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-3-methyl-anilino]-N-[[4-(1-piperidyl)phenyl]methyl]acetamide CAS Name: 2-[N-(benzenesulfonyl)-3-methylanilino]-N-[[4-(1-piperidinyl)phenyl]methyl]acetamide IUPAC Name: 2-[N-(benzenesulfonyl)-3-methylanilino]-N-[(4-piperidin-1-ylphenyl)methyl]acetamide Traditional Name: 2-(N-besyl-3-methyl-anilino)-N-(4-piperidinobenzyl)acetamide Formula: C27H31N3O3S MolecularWeight: 477.61834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(CC(=O)NCC2=CC=C(C=C2)N3CCCCC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)N(CC(=O)NCC2=CC=C(C=C2)N3CCCCC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H31N3O3S/c1-22-9-8-10-25(19-22)30(34(32,33)26-11-4-2-5-12-26)21-27(31)28-20-23-13-15-24(16-14-23)29-17-6-3-7-18-29/h2,4-5,8-16,19H,3,6-7,17-18,20-21H2,1H3,(H,28,31)