2-methyl-4-(4-methylphenyl)sulfonyl-6-oxidanylidene-N-(phenylmethyl)-1-(thiophen-2-ylmethyl)piperazine-2-carboxamide

Systemtic Name: 2-methyl-4-(4-methylphenyl)sulfonyl-6-oxidanylidene-N-(phenylmethyl)-1-(thiophen-2-ylmethyl)piperazine-2-carboxamide Openeye Name: N-benzyl-2-methyl-6-oxo-4-(p-tolylsulfonyl)-1-(2-thienylmethyl)piperazine-2-carboxamide CAS Name: 2-methyl-4-(4-methylphenyl)sulfonyl-6-oxo-N-(phenylmethyl)-1-(thiophen-2-ylmethyl)-2-piperazinecarboxamide IUPAC Name: N-benzyl-2-methyl-4-(4-methylphenyl)sulfonyl-6-oxo-1-(thiophen-2-ylmethyl)piperazine-2-carboxamide Traditional Name: N-benzyl-6-keto-2-methyl-1-(2-thenyl)-4-tosyl-piperazine-2-carboxamide Formula: C25H27N3O4S2 MolecularWeight: 497.62958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC(=O)N(C(C2)(C)C(=O)NCC3=CC=CC=C3)CC4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC(=O)N(C(C2)(C)C(=O)NCC3=CC=CC=C3)CC4=CC=CS4

InChI

InChI=1S/C25H27N3O4S2/c1-19-10-12-22(13-11-19)34(31,32)27-17-23(29)28(16-21-9-6-14-33-21)25(2,18-27)24(30)26-15-20-7-4-3-5-8-20/h3-14H,15-18H2,1-2H3,(H,26,30)