1-(3-ethylphenyl)-2-methyl-N-(3-methylbutyl)-6-oxidanylidene-4-(phenylsulfonyl)piperazine-2-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)N2C(=O)CN(CC2(C)C(=O)NCCC(C)C)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCC1=CC(=CC=C1)N2C(=O)CN(CC2(C)C(=O)NCCC(C)C)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H33N3O4S/c1-5-20-10-9-11-21(16-20)28-23(29)17-27(33(31,32)22-12-7-6-8-13-22)18-25(28,4)24(30)26-15-14-19(2)3/h6-13,16,19H,5,14-15,17-18H2,1-4H3,(H,26,30)