N-(6-imidazol-1-ylpyridin-3-yl)-4-oxidanylidene-4-[4-(phenylsulfonyl)piperazin-1-yl]butanamide

Systemtic Name: N-(6-imidazol-1-ylpyridin-3-yl)-4-oxidanylidene-4-[4-(phenylsulfonyl)piperazin-1-yl]butanamide Openeye Name: 4-[4-(benzenesulfonyl)piperazin-1-yl]-N-(6-imidazol-1-yl-3-pyridyl)-4-oxo-butanamide CAS Name: 4-[4-(benzenesulfonyl)-1-piperazinyl]-N-[6-(1-imidazolyl)-3-pyridinyl]-4-oxobutanamide IUPAC Name: 4-[4-(benzenesulfonyl)piperazin-1-yl]-N-(6-imidazol-1-ylpyridin-3-yl)-4-oxobutanamide Traditional Name: 4-(4-besylpiperazino)-N-(6-imidazol-1-yl-3-pyridyl)-4-keto-butyramide Formula: C22H24N6O4S MolecularWeight: 468.52876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCC(=O)NC2=CN=C(C=C2)N3C=CN=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)CCC(=O)NC2=CN=C(C=C2)N3C=CN=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H24N6O4S/c29-21(25-18-6-7-20(24-16-18)27-11-10-23-17-27)8-9-22(30)26-12-14-28(15-13-26)33(31,32)19-4-2-1-3-5-19/h1-7,10-11,16-17H,8-9,12-15H2,(H,25,29)