2-[4-(3-chloranyl-2-methyl-phenyl)sulfonylpiperazin-1-yl]-6-methyl-1H-benzimidazole

Systemtic Name: 2-[4-(3-chloranyl-2-methyl-phenyl)sulfonylpiperazin-1-yl]-6-methyl-1H-benzimidazole Openeye Name: 2-[4-(3-chloro-2-methyl-phenyl)sulfonylpiperazin-1-yl]-6-methyl-1H-benzimidazole CAS Name: 2-[4-(3-chloro-2-methylphenyl)sulfonyl-1-piperazinyl]-6-methyl-1H-benzimidazole IUPAC Name: 2-[4-(3-chloro-2-methylphenyl)sulfonylpiperazin-1-yl]-6-methyl-1H-benzimidazole Traditional Name: 2-[4-(3-chloro-2-methyl-phenyl)sulfonylpiperazino]-6-methyl-1H-benzimidazole Formula: C19H21ClN4O2S MolecularWeight: 404.91364

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21ClN4O2S/c1-13-6-7-16-17(12-13)22-19(21-16)23-8-10-24(11-9-23)27(25,26)18-5-3-4-15(20)14(18)2/h3-7,12H,8-11H2,1-2H3,(H,21,22)