1-[(4-methoxyphenyl)methyl]-2-methyl-4-methylsulfonyl-6-oxidanylidene-N-(phenylmethyl)piperazine-2-carboxamide

Systemtic Name: 1-[(4-methoxyphenyl)methyl]-2-methyl-4-methylsulfonyl-6-oxidanylidene-N-(phenylmethyl)piperazine-2-carboxamide Openeye Name: N-benzyl-1-[(4-methoxyphenyl)methyl]-2-methyl-4-methylsulfonyl-6-oxo-piperazine-2-carboxamide CAS Name: 1-[(4-methoxyphenyl)methyl]-2-methyl-4-methylsulfonyl-6-oxo-N-(phenylmethyl)-2-piperazinecarboxamide IUPAC Name: N-benzyl-1-[(4-methoxyphenyl)methyl]-2-methyl-4-methylsulfonyl-6-oxopiperazine-2-carboxamide Traditional Name: N-benzyl-6-keto-4-mesyl-2-methyl-1-p-anisyl-piperazine-2-carboxamide Formula: C22H27N3O5S MolecularWeight: 445.53188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(CC(=O)N1CC2=CC=C(C=C2)OC)S(=O)(=O)C)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC1(CN(CC(=O)N1CC2=CC=C(C=C2)OC)S(=O)(=O)C)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O5S/c1-22(21(27)23-13-17-7-5-4-6-8-17)16-24(31(3,28)29)15-20(26)25(22)14-18-9-11-19(30-2)12-10-18/h4-12H,13-16H2,1-3H3,(H,23,27)