1-ethanoyl-4-(4-methylphenyl)sulfonyl-N-(phenylmethyl)piperazine-2-carboxamide

Systemtic Name: 1-ethanoyl-4-(4-methylphenyl)sulfonyl-N-(phenylmethyl)piperazine-2-carboxamide Openeye Name: 1-acetyl-N-benzyl-4-(p-tolylsulfonyl)piperazine-2-carboxamide CAS Name: 1-acetyl-4-(4-methylphenyl)sulfonyl-N-(phenylmethyl)-2-piperazinecarboxamide IUPAC Name: 1-acetyl-N-benzyl-4-(4-methylphenyl)sulfonylpiperazine-2-carboxamide Traditional Name: 1-acetyl-N-benzyl-4-tosyl-piperazine-2-carboxamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(C(C2)C(=O)NCC3=CC=CC=C3)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(C(C2)C(=O)NCC3=CC=CC=C3)C(=O)C

InChI

InChI=1S/C21H25N3O4S/c1-16-8-10-19(11-9-16)29(27,28)23-12-13-24(17(2)25)20(15-23)21(26)22-14-18-6-4-3-5-7-18/h3-11,20H,12-15H2,1-2H3,(H,22,26)