N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)-2-[4-(phenylsulfonyl)piperazin-1-yl]propanamide

Systemtic Name: N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)-2-[4-(phenylsulfonyl)piperazin-1-yl]propanamide Openeye Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide CAS Name: 2-[4-(benzenesulfonyl)-1-piperazinyl]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide IUPAC Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide Traditional Name: 2-(4-besylpiperazino)-N-(2-keto-1,3-dihydrobenzimidazol-5-yl)propionamide Formula: C20H23N5O4S MolecularWeight: 429.49272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)NC(=O)N2)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C(=O)NC1=CC2=C(C=C1)NC(=O)N2)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H23N5O4S/c1-14(19(26)21-15-7-8-17-18(13-15)23-20(27)22-17)24-9-11-25(12-10-24)30(28,29)16-5-3-2-4-6-16/h2-8,13-14H,9-12H2,1H3,(H,21,26)(H2,22,23,27)