4-[1-methyl-5-[2-morpholin-4-ylethyl(quinolin-8-ylsulfonyl)amino]benzimidazol-2-yl]carbonylbenzenecarboximidamide dihydrochloride

Systemtic Name: 4-[1-methyl-5-[2-morpholin-4-ylethyl(quinolin-8-ylsulfonyl)amino]benzimidazol-2-yl]carbonylbenzenecarboximidamide dihydrochloride Openeye Name: 4-[1-methyl-5-[2-morpholinoethyl(8-quinolylsulfonyl)amino]benzimidazole-2-carbonyl]benzamidine dihydrochloride CAS Name: 4-[[1-methyl-5-[2-(4-morpholinyl)ethyl-(8-quinolinylsulfonyl)amino]-2-benzimidazolyl]-oxomethyl]benzenecarboximidamide dihydrochloride IUPAC Name: 4-[1-methyl-5-[2-morpholin-4-ylethyl(quinolin-8-ylsulfonyl)amino]benzimidazole-2-carbonyl]benzenecarboximidamide dihydrochloride Traditional Name: 4-[1-methyl-5-[2-morpholinoethyl(8-quinolylsulfonyl)amino]benzimidazole-2-carbonyl]benzamidine dihydrochloride Formula: C31H33Cl2N7O4S MolecularWeight: 670.60922

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)N(CCN3CCOCC3)S(=O)(=O)C4=CC=CC5=C4N=CC=C5)N=C1C(=O)C6=CC=C(C=C6)C(=N)N.Cl.Cl

Isomeric SMILES

CN1C2=C(C=C(C=C2)N(CCN3CCOCC3)S(=O)(=O)C4=CC=CC5=C4N=CC=C5)N=C1C(=O)C6=CC=C(C=C6)C(=N)N.Cl.Cl

InChI

InChI=1S/C31H31N7O4S.2ClH/c1-36-26-12-11-24(20-25(26)35-31(36)29(39)22-7-9-23(10-8-22)30(32)33)38(15-14-37-16-18-42-19-17-37)43(40,41)27-6-2-4-21-5-3-13-34-28(21)27;;/h2-13,20H,14-19H2,1H3,(H3,32,33);2*1H