N-cyclopentyl-2-methyl-1-(2-methylphenyl)-6-oxidanylidene-4-propylsulfonyl-piperazine-2-carboxamide

Systemtic Name: N-cyclopentyl-2-methyl-1-(2-methylphenyl)-6-oxidanylidene-4-propylsulfonyl-piperazine-2-carboxamide Openeye Name: N-cyclopentyl-2-methyl-1-(o-tolyl)-6-oxo-4-propylsulfonyl-piperazine-2-carboxamide CAS Name: N-cyclopentyl-2-methyl-1-(2-methylphenyl)-6-oxo-4-propylsulfonyl-2-piperazinecarboxamide IUPAC Name: N-cyclopentyl-2-methyl-1-(2-methylphenyl)-6-oxo-4-propylsulfonylpiperazine-2-carboxamide Traditional Name: N-cyclopentyl-6-keto-2-methyl-1-(o-tolyl)-4-propylsulfonyl-piperazine-2-carboxamide Formula: C21H31N3O4S MolecularWeight: 421.55354

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CC(=O)N(C(C1)(C)C(=O)NC2CCCC2)C3=CC=CC=C3C

Isomeric SMILES

CCCS(=O)(=O)N1CC(=O)N(C(C1)(C)C(=O)NC2CCCC2)C3=CC=CC=C3C

InChI

InChI=1S/C21H31N3O4S/c1-4-13-29(27,28)23-14-19(25)24(18-12-8-5-9-16(18)2)21(3,15-23)20(26)22-17-10-6-7-11-17/h5,8-9,12,17H,4,6-7,10-11,13-15H2,1-3H3,(H,22,26)