4-[[4-methyl-7-[1-(2-methylpropyl)-1,2,3,4-tetrazol-5-yl]-3-oxidanylidene-quinoxalin-2-yl]methyl]benzenecarboximidamide hydrochloride

Systemtic Name: 4-[[4-methyl-7-[1-(2-methylpropyl)-1,2,3,4-tetrazol-5-yl]-3-oxidanylidene-quinoxalin-2-yl]methyl]benzenecarboximidamide hydrochloride Openeye Name: 4-[[7-(1-isobutyltetrazol-5-yl)-4-methyl-3-oxo-quinoxalin-2-yl]methyl]benzamidine hydrochloride CAS Name: 4-[[4-methyl-7-[1-(2-methylpropyl)-5-tetrazolyl]-3-oxo-2-quinoxalinyl]methyl]benzenecarboximidamide hydrochloride IUPAC Name: 4-[[4-methyl-7-[1-(2-methylpropyl)tetrazol-5-yl]-3-oxoquinoxalin-2-yl]methyl]benzenecarboximidamide hydrochloride Traditional Name: 4-[[7-(1-isobutyltetrazol-5-yl)-3-keto-4-methyl-quinoxalin-2-yl]methyl]benzamidine hydrochloride Formula: C22H25ClN8O MolecularWeight: 452.9399

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=NN=N1)C2=CC3=C(C=C2)N(C(=O)C(=N3)CC4=CC=C(C=C4)C(=N)N)C.Cl

Isomeric SMILES

CC(C)CN1C(=NN=N1)C2=CC3=C(C=C2)N(C(=O)C(=N3)CC4=CC=C(C=C4)C(=N)N)C.Cl

InChI

InChI=1S/C22H24N8O.ClH/c1-13(2)12-30-21(26-27-28-30)16-8-9-19-17(11-16)25-18(22(31)29(19)3)10-14-4-6-15(7-5-14)20(23)24;/h4-9,11,13H,10,12H2,1-3H3,(H3,23,24);1H