3H-benzimidazol-5-yl-[4-(6-chloranylnaphthalen-2-yl)sulfonylpiperazin-1-yl]methanone hydrochloride

Systemtic Name: 3H-benzimidazol-5-yl-[4-(6-chloranylnaphthalen-2-yl)sulfonylpiperazin-1-yl]methanone hydrochloride Openeye Name: 3H-benzimidazol-5-yl-[4-[(6-chloro-2-naphthyl)sulfonyl]piperazin-1-yl]methanone hydrochloride CAS Name: 3H-benzimidazol-5-yl-[4-[(6-chloro-2-naphthalenyl)sulfonyl]-1-piperazinyl]methanone hydrochloride IUPAC Name: 3H-benzimidazol-5-yl-[4-(6-chloronaphthalen-2-yl)sulfonylpiperazin-1-yl]methanone hydrochloride Traditional Name: 3H-benzimidazol-5-yl-[4-[(6-chloro-2-naphthyl)sulfonyl]piperazino]methanone hydrochloride Formula: C22H20Cl2N4O3S MolecularWeight: 491.3902

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC3=C(C=C2)N=CN3)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl.Cl

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC3=C(C=C2)N=CN3)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl.Cl

InChI

InChI=1S/C22H19ClN4O3S.ClH/c23-18-4-1-16-12-19(5-2-15(16)11-18)31(29,30)27-9-7-26(8-10-27)22(28)17-3-6-20-21(13-17)25-14-24-20;/h1-6,11-14H,7-10H2,(H,24,25);1H