1-methyl-2-[[4-(4-propylphenyl)sulfonylpiperazin-1-yl]methyl]benzimidazole

Systemtic Name: 1-methyl-2-[[4-(4-propylphenyl)sulfonylpiperazin-1-yl]methyl]benzimidazole Openeye Name: 1-methyl-2-[[4-(4-propylphenyl)sulfonylpiperazin-1-yl]methyl]benzimidazole CAS Name: 1-methyl-2-[[4-(4-propylphenyl)sulfonyl-1-piperazinyl]methyl]benzimidazole IUPAC Name: 1-methyl-2-[[4-(4-propylphenyl)sulfonylpiperazin-1-yl]methyl]benzimidazole Traditional Name: 1-methyl-2-[[4-(4-propylphenyl)sulfonylpiperazino]methyl]benzimidazole Formula: C22H28N4O2S MolecularWeight: 412.54832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4N3C

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4N3C

InChI

InChI=1S/C22H28N4O2S/c1-3-6-18-9-11-19(12-10-18)29(27,28)26-15-13-25(14-16-26)17-22-23-20-7-4-5-8-21(20)24(22)2/h4-5,7-12H,3,6,13-17H2,1-2H3