N-[4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]phenyl]-2-naphthalen-2-ylsulfonyl-ethanamide

Systemtic Name: N-[4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]phenyl]-2-naphthalen-2-ylsulfonyl-ethanamide Openeye Name: N-[4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]-2-(2-naphthylsulfonyl)acetamide CAS Name: N-[4-[4-[(2-methylphenyl)-oxomethyl]-1-piperazinyl]phenyl]-2-(2-naphthalenylsulfonyl)acetamide IUPAC Name: N-[4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]-2-naphthalen-2-ylsulfonylacetamide Traditional Name: 2-(2-naphthylsulfonyl)-N-[4-(4-o-toluoylpiperazino)phenyl]acetamide Formula: C30H29N3O4S MolecularWeight: 527.63396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)CS(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)CS(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C30H29N3O4S/c1-22-6-2-5-9-28(22)30(35)33-18-16-32(17-19-33)26-13-11-25(12-14-26)31-29(34)21-38(36,37)27-15-10-23-7-3-4-8-24(23)20-27/h2-15,20H,16-19,21H2,1H3,(H,31,34)