3-(1-methyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)-1-(4-phenylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-(1-methyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)-1-(4-phenylpiperazin-1-yl)propan-1-one Openeye Name: 3-[1-methyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]-1-(4-phenylpiperazin-1-yl)propan-1-one CAS Name: 3-[1-methyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]-1-(4-phenyl-1-piperazinyl)-1-propanone IUPAC Name: 3-(1-methyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)-1-(4-phenylpiperazin-1-yl)propan-1-one Traditional Name: 3-(1-methyl-5-piperidinosulfonyl-benzimidazol-2-yl)-1-(4-phenylpiperazino)propan-1-one Formula: C26H33N5O3S MolecularWeight: 495.63692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CCC(=O)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CCC(=O)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C26H33N5O3S/c1-28-24-11-10-22(35(33,34)31-14-6-3-7-15-31)20-23(24)27-25(28)12-13-26(32)30-18-16-29(17-19-30)21-8-4-2-5-9-21/h2,4-5,8-11,20H,3,6-7,12-19H2,1H3