4-ethylsulfonyl-1-(4-methoxyphenyl)-2-methyl-6-oxidanylidene-N-(phenylmethyl)piperazine-2-carboxamide

Systemtic Name: 4-ethylsulfonyl-1-(4-methoxyphenyl)-2-methyl-6-oxidanylidene-N-(phenylmethyl)piperazine-2-carboxamide Openeye Name: N-benzyl-4-ethylsulfonyl-1-(4-methoxyphenyl)-2-methyl-6-oxo-piperazine-2-carboxamide CAS Name: 4-ethylsulfonyl-1-(4-methoxyphenyl)-2-methyl-6-oxo-N-(phenylmethyl)-2-piperazinecarboxamide IUPAC Name: N-benzyl-4-ethylsulfonyl-1-(4-methoxyphenyl)-2-methyl-6-oxopiperazine-2-carboxamide Traditional Name: N-benzyl-4-esyl-6-keto-1-(4-methoxyphenyl)-2-methyl-piperazine-2-carboxamide Formula: C22H27N3O5S MolecularWeight: 445.53188

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O5S/c1-4-31(28,29)24-15-20(26)25(18-10-12-19(30-3)13-11-18)22(2,16-24)21(27)23-14-17-8-6-5-7-9-17/h5-13H,4,14-16H2,1-3H3,(H,23,27)