2-methyl-N-(3-methylbutyl)-1-[(4-methylphenyl)methyl]-6-oxidanylidene-4-(phenylsulfonyl)piperazine-2-carboxamide

Systemtic Name: 2-methyl-N-(3-methylbutyl)-1-[(4-methylphenyl)methyl]-6-oxidanylidene-4-(phenylsulfonyl)piperazine-2-carboxamide Openeye Name: 4-(benzenesulfonyl)-N-isopentyl-2-methyl-6-oxo-1-(p-tolylmethyl)piperazine-2-carboxamide CAS Name: 4-(benzenesulfonyl)-2-methyl-N-(3-methylbutyl)-1-[(4-methylphenyl)methyl]-6-oxo-2-piperazinecarboxamide IUPAC Name: 4-(benzenesulfonyl)-2-methyl-N-(3-methylbutyl)-1-[(4-methylphenyl)methyl]-6-oxopiperazine-2-carboxamide Traditional Name: 4-besyl-N-isoamyl-6-keto-2-methyl-1-(4-methylbenzyl)piperazine-2-carboxamide Formula: C25H33N3O4S MolecularWeight: 471.61222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=O)CN(CC2(C)C(=O)NCCC(C)C)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=O)CN(CC2(C)C(=O)NCCC(C)C)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H33N3O4S/c1-19(2)14-15-26-24(30)25(4)18-27(33(31,32)22-8-6-5-7-9-22)17-23(29)28(25)16-21-12-10-20(3)11-13-21/h5-13,19H,14-18H2,1-4H3,(H,26,30)