N-[bis(azanyl)methylidene]-2-(5-methyl-1,2-oxazol-3-yl)-1-oxidanylidene-isoquinoline-4-carboxamide hydrochloride

Systemtic Name: N-[bis(azanyl)methylidene]-2-(5-methyl-1,2-oxazol-3-yl)-1-oxidanylidene-isoquinoline-4-carboxamide hydrochloride Openeye Name: N-(diaminomethylene)-2-(5-methylisoxazol-3-yl)-1-oxo-isoquinoline-4-carboxamide hydrochloride CAS Name: N-(diaminomethylidene)-2-(5-methyl-3-isoxazolyl)-1-oxo-4-isoquinolinecarboxamide hydrochloride IUPAC Name: N-(diaminomethylidene)-2-(5-methyl-1,2-oxazol-3-yl)-1-oxoisoquinoline-4-carboxamide hydrochloride Traditional Name: N-(diaminomethylene)-1-keto-2-(5-methylisoxazol-3-yl)isoquinoline-4-carboxamide hydrochloride Formula: C15H14ClN5O3 MolecularWeight: 347.75636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)N2C=C(C3=CC=CC=C3C2=O)C(=O)N=C(N)N.Cl

Isomeric SMILES

CC1=CC(=NO1)N2C=C(C3=CC=CC=C3C2=O)C(=O)N=C(N)N.Cl

InChI

InChI=1S/C15H13N5O3.ClH/c1-8-6-12(19-23-8)20-7-11(13(21)18-15(16)17)9-4-2-3-5-10(9)14(20)22;/h2-7H,1H3,(H4,16,17,18,21);1H