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

Systemtic Name: 2-methyl-N-[(4-methylphenyl)methyl]-6-oxidanylidene-4-(phenylsulfonyl)-1-propyl-piperazine-2-carboxamide Openeye Name: 4-(benzenesulfonyl)-2-methyl-6-oxo-1-propyl-N-(p-tolylmethyl)piperazine-2-carboxamide CAS Name: 4-(benzenesulfonyl)-2-methyl-N-[(4-methylphenyl)methyl]-6-oxo-1-propyl-2-piperazinecarboxamide IUPAC Name: 4-(benzenesulfonyl)-2-methyl-N-[(4-methylphenyl)methyl]-6-oxo-1-propylpiperazine-2-carboxamide Traditional Name: 4-besyl-6-keto-2-methyl-N-(4-methylbenzyl)-1-propyl-piperazine-2-carboxamide Formula: C23H29N3O4S MolecularWeight: 443.55906

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)CN(CC1(C)C(=O)NCC2=CC=C(C=C2)C)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCCN1C(=O)CN(CC1(C)C(=O)NCC2=CC=C(C=C2)C)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H29N3O4S/c1-4-14-26-21(27)16-25(31(29,30)20-8-6-5-7-9-20)17-23(26,3)22(28)24-15-19-12-10-18(2)11-13-19/h5-13H,4,14-17H2,1-3H3,(H,24,28)