5-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]sulfonyl-1,3-diethyl-benzimidazol-2-one

Systemtic Name: 5-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]sulfonyl-1,3-diethyl-benzimidazol-2-one Openeye Name: 5-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]sulfonyl-1,3-diethyl-benzimidazol-2-one CAS Name: 5-[[4-(5-chloro-2-methylphenyl)-1-piperazinyl]sulfonyl]-1,3-diethyl-2-benzimidazolone IUPAC Name: 5-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]sulfonyl-1,3-diethylbenzimidazol-2-one Traditional Name: 5-[4-(5-chloro-2-methyl-phenyl)piperazino]sulfonyl-1,3-diethyl-benzimidazol-2-one Formula: C22H27ClN4O3S MolecularWeight: 462.99278

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=C(C=CC(=C4)Cl)C)N(C1=O)CC

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=C(C=CC(=C4)Cl)C)N(C1=O)CC

InChI

InChI=1S/C22H27ClN4O3S/c1-4-26-19-9-8-18(15-21(19)27(5-2)22(26)28)31(29,30)25-12-10-24(11-13-25)20-14-17(23)7-6-16(20)3/h6-9,14-15H,4-5,10-13H2,1-3H3