1-(2-ethylphenyl)-2-methyl-4-methylsulfonyl-6-oxidanylidene-N-(phenylmethyl)piperazine-2-carboxamide

Systemtic Name: 1-(2-ethylphenyl)-2-methyl-4-methylsulfonyl-6-oxidanylidene-N-(phenylmethyl)piperazine-2-carboxamide Openeye Name: N-benzyl-1-(2-ethylphenyl)-2-methyl-4-methylsulfonyl-6-oxo-piperazine-2-carboxamide CAS Name: 1-(2-ethylphenyl)-2-methyl-4-methylsulfonyl-6-oxo-N-(phenylmethyl)-2-piperazinecarboxamide IUPAC Name: N-benzyl-1-(2-ethylphenyl)-2-methyl-4-methylsulfonyl-6-oxopiperazine-2-carboxamide Traditional Name: N-benzyl-1-(2-ethylphenyl)-6-keto-4-mesyl-2-methyl-piperazine-2-carboxamide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N2C(=O)CN(CC2(C)C(=O)NCC3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

CCC1=CC=CC=C1N2C(=O)CN(CC2(C)C(=O)NCC3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C22H27N3O4S/c1-4-18-12-8-9-13-19(18)25-20(26)15-24(30(3,28)29)16-22(25,2)21(27)23-14-17-10-6-5-7-11-17/h5-13H,4,14-16H2,1-3H3,(H,23,27)