2-[[4-(2-methoxy-5-methyl-phenyl)sulfonylpiperazin-1-yl]methyl]-1H-benzimidazole

Systemtic Name: 2-[[4-(2-methoxy-5-methyl-phenyl)sulfonylpiperazin-1-yl]methyl]-1H-benzimidazole Openeye Name: 2-[[4-(2-methoxy-5-methyl-phenyl)sulfonylpiperazin-1-yl]methyl]-1H-benzimidazole CAS Name: 2-[[4-(2-methoxy-5-methylphenyl)sulfonyl-1-piperazinyl]methyl]-1H-benzimidazole IUPAC Name: 2-[[4-(2-methoxy-5-methylphenyl)sulfonylpiperazin-1-yl]methyl]-1H-benzimidazole Traditional Name: 2-[[4-(2-methoxy-5-methyl-phenyl)sulfonylpiperazino]methyl]-1H-benzimidazole Formula: C20H24N4O3S MolecularWeight: 400.49456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4N3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C20H24N4O3S/c1-15-7-8-18(27-2)19(13-15)28(25,26)24-11-9-23(10-12-24)14-20-21-16-5-3-4-6-17(16)22-20/h3-8,13H,9-12,14H2,1-2H3,(H,21,22)