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

Systemtic Name: N-[(4-fluorophenyl)methyl]-2-methyl-1-(4-methylphenyl)-6-oxidanylidene-4-(phenylsulfonyl)piperazine-2-carboxamide Openeye Name: 4-(benzenesulfonyl)-N-[(4-fluorophenyl)methyl]-2-methyl-6-oxo-1-(p-tolyl)piperazine-2-carboxamide CAS Name: 4-(benzenesulfonyl)-N-[(4-fluorophenyl)methyl]-2-methyl-1-(4-methylphenyl)-6-oxo-2-piperazinecarboxamide IUPAC Name: 4-(benzenesulfonyl)-N-[(4-fluorophenyl)methyl]-2-methyl-1-(4-methylphenyl)-6-oxopiperazine-2-carboxamide Traditional Name: 4-besyl-N-(4-fluorobenzyl)-6-keto-2-methyl-1-(p-tolyl)piperazine-2-carboxamide Formula: C26H26FN3O4S MolecularWeight: 495.565743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)CN(CC2(C)C(=O)NCC3=CC=C(C=C3)F)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)CN(CC2(C)C(=O)NCC3=CC=C(C=C3)F)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H26FN3O4S/c1-19-8-14-22(15-9-19)30-24(31)17-29(35(33,34)23-6-4-3-5-7-23)18-26(30,2)25(32)28-16-20-10-12-21(27)13-11-20/h3-15H,16-18H2,1-2H3,(H,28,32)