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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)N2C(=O)CN(CC2(C)C(=O)NCC3=CC=CC=C3)S(=O)(=O)CC

Isomeric SMILES

CCC1=CC(=CC=C1)N2C(=O)CN(CC2(C)C(=O)NCC3=CC=CC=C3)S(=O)(=O)CC

InChI

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