1-[2-(furan-2-yl)ethyl]-2-methyl-4-(4-methylphenyl)sulfonyl-6-oxidanylidene-N-(phenylmethyl)piperazine-2-carboxamide

Systemtic Name: 1-[2-(furan-2-yl)ethyl]-2-methyl-4-(4-methylphenyl)sulfonyl-6-oxidanylidene-N-(phenylmethyl)piperazine-2-carboxamide Openeye Name: N-benzyl-1-[2-(2-furyl)ethyl]-2-methyl-6-oxo-4-(p-tolylsulfonyl)piperazine-2-carboxamide CAS Name: 1-[2-(2-furanyl)ethyl]-2-methyl-4-(4-methylphenyl)sulfonyl-6-oxo-N-(phenylmethyl)-2-piperazinecarboxamide IUPAC Name: N-benzyl-1-[2-(furan-2-yl)ethyl]-2-methyl-4-(4-methylphenyl)sulfonyl-6-oxopiperazine-2-carboxamide Traditional Name: N-benzyl-1-[2-(2-furyl)ethyl]-6-keto-2-methyl-4-tosyl-piperazine-2-carboxamide Formula: C26H29N3O5S MolecularWeight: 495.59056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC(=O)N(C(C2)(C)C(=O)NCC3=CC=CC=C3)CCC4=CC=CO4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC(=O)N(C(C2)(C)C(=O)NCC3=CC=CC=C3)CCC4=CC=CO4

InChI

InChI=1S/C26H29N3O5S/c1-20-10-12-23(13-11-20)35(32,33)28-18-24(30)29(15-14-22-9-6-16-34-22)26(2,19-28)25(31)27-17-21-7-4-3-5-8-21/h3-13,16H,14-15,17-19H2,1-2H3,(H,27,31)