1-[(4-ethoxy-3-methoxy-phenyl)methyl]-2-methyl-4-methylsulfonyl-6-oxidanylidene-N-(phenylmethyl)piperazine-2-carboxamide

Systemtic Name: 1-[(4-ethoxy-3-methoxy-phenyl)methyl]-2-methyl-4-methylsulfonyl-6-oxidanylidene-N-(phenylmethyl)piperazine-2-carboxamide Openeye Name: N-benzyl-1-[(4-ethoxy-3-methoxy-phenyl)methyl]-2-methyl-4-methylsulfonyl-6-oxo-piperazine-2-carboxamide CAS Name: 1-[(4-ethoxy-3-methoxyphenyl)methyl]-2-methyl-4-methylsulfonyl-6-oxo-N-(phenylmethyl)-2-piperazinecarboxamide IUPAC Name: N-benzyl-1-[(4-ethoxy-3-methoxyphenyl)methyl]-2-methyl-4-methylsulfonyl-6-oxopiperazine-2-carboxamide Traditional Name: N-benzyl-1-(4-ethoxy-3-methoxy-benzyl)-6-keto-4-mesyl-2-methyl-piperazine-2-carboxamide Formula: C24H31N3O6S MolecularWeight: 489.58444

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CN2C(=O)CN(CC2(C)C(=O)NCC3=CC=CC=C3)S(=O)(=O)C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CN2C(=O)CN(CC2(C)C(=O)NCC3=CC=CC=C3)S(=O)(=O)C)OC

InChI

InChI=1S/C24H31N3O6S/c1-5-33-20-12-11-19(13-21(20)32-3)15-27-22(28)16-26(34(4,30)31)17-24(27,2)23(29)25-14-18-9-7-6-8-10-18/h6-13H,5,14-17H2,1-4H3,(H,25,29)