1-(3,4-dimethylphenyl)-4-ethylsulfonyl-2-methyl-6-oxidanylidene-N-(phenylmethyl)piperazine-2-carboxamide

Systemtic Name: 1-(3,4-dimethylphenyl)-4-ethylsulfonyl-2-methyl-6-oxidanylidene-N-(phenylmethyl)piperazine-2-carboxamide Openeye Name: N-benzyl-1-(3,4-dimethylphenyl)-4-ethylsulfonyl-2-methyl-6-oxo-piperazine-2-carboxamide CAS Name: 1-(3,4-dimethylphenyl)-4-ethylsulfonyl-2-methyl-6-oxo-N-(phenylmethyl)-2-piperazinecarboxamide IUPAC Name: N-benzyl-1-(3,4-dimethylphenyl)-4-ethylsulfonyl-2-methyl-6-oxopiperazine-2-carboxamide Traditional Name: N-benzyl-1-(3,4-dimethylphenyl)-4-esyl-6-keto-2-methyl-piperazine-2-carboxamide Formula: C23H29N3O4S MolecularWeight: 443.55906

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CC(=O)N(C(C1)(C)C(=O)NCC2=CC=CC=C2)C3=CC(=C(C=C3)C)C

Isomeric SMILES

CCS(=O)(=O)N1CC(=O)N(C(C1)(C)C(=O)NCC2=CC=CC=C2)C3=CC(=C(C=C3)C)C

InChI

InChI=1S/C23H29N3O4S/c1-5-31(29,30)25-15-21(27)26(20-12-11-17(2)18(3)13-20)23(4,16-25)22(28)24-14-19-9-7-6-8-10-19/h6-13H,5,14-16H2,1-4H3,(H,24,28)