5,6-dimethyl-1-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]sulfonyl-benzimidazole

Systemtic Name: 5,6-dimethyl-1-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]sulfonyl-benzimidazole Openeye Name: 5,6-dimethyl-1-[4-[(2-methyl-1-piperidyl)sulfonyl]phenyl]sulfonyl-benzimidazole CAS Name: 5,6-dimethyl-1-[4-[(2-methyl-1-piperidinyl)sulfonyl]phenyl]sulfonylbenzimidazole IUPAC Name: 5,6-dimethyl-1-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]sulfonylbenzimidazole Traditional Name: 5,6-dimethyl-1-[4-(2-methylpiperidino)sulfonylphenyl]sulfonyl-benzimidazole Formula: C21H25N3O4S2 MolecularWeight: 447.5709

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3C=NC4=C3C=C(C(=C4)C)C

Isomeric SMILES

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3C=NC4=C3C=C(C(=C4)C)C

InChI

InChI=1S/C21H25N3O4S2/c1-15-12-20-21(13-16(15)2)24(14-22-20)30(27,28)19-9-7-18(8-10-19)29(25,26)23-11-5-4-6-17(23)3/h7-10,12-14,17H,4-6,11H2,1-3H3