6-methyl-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]-1H-benzimidazole

Systemtic Name: 6-methyl-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]-1H-benzimidazole Openeye Name: 2-[4-(4-isopropylphenyl)sulfonylpiperazin-1-yl]-6-methyl-1H-benzimidazole CAS Name: 6-methyl-2-[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazinyl]-1H-benzimidazole IUPAC Name: 6-methyl-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]-1H-benzimidazole Traditional Name: 6-methyl-2-(4-p-cumenylsulfonylpiperazino)-1H-benzimidazole Formula: C21H26N4O2S MolecularWeight: 398.52174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C(C)C

InChI

InChI=1S/C21H26N4O2S/c1-15(2)17-5-7-18(8-6-17)28(26,27)25-12-10-24(11-13-25)21-22-19-9-4-16(3)14-20(19)23-21/h4-9,14-15H,10-13H2,1-3H3,(H,22,23)