3-[[4-(6-chloranylnaphthalen-2-yl)sulfonyl-2-oxidanylidene-piperazin-1-yl]methyl]benzenecarboximidamide hydrochloride

Systemtic Name: 3-[[4-(6-chloranylnaphthalen-2-yl)sulfonyl-2-oxidanylidene-piperazin-1-yl]methyl]benzenecarboximidamide hydrochloride Openeye Name: 3-[[4-[(6-chloro-2-naphthyl)sulfonyl]-2-oxo-piperazin-1-yl]methyl]benzamidine hydrochloride CAS Name: 3-[[4-[(6-chloro-2-naphthalenyl)sulfonyl]-2-oxo-1-piperazinyl]methyl]benzenecarboximidamide hydrochloride IUPAC Name: 3-[[4-(6-chloronaphthalen-2-yl)sulfonyl-2-oxopiperazin-1-yl]methyl]benzenecarboximidamide hydrochloride Traditional Name: 3-[[4-[(6-chloro-2-naphthyl)sulfonyl]-2-keto-piperazino]methyl]benzamidine hydrochloride Formula: C22H22Cl2N4O3S MolecularWeight: 493.40608

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)CN1S(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Cl)CC4=CC=CC(=C4)C(=N)N.Cl

Isomeric SMILES

C1CN(C(=O)CN1S(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Cl)CC4=CC=CC(=C4)C(=N)N.Cl

InChI

InChI=1S/C22H21ClN4O3S.ClH/c23-19-6-4-17-12-20(7-5-16(17)11-19)31(29,30)27-9-8-26(21(28)14-27)13-15-2-1-3-18(10-15)22(24)25;/h1-7,10-12H,8-9,13-14H2,(H3,24,25);1H