3-[2-(3-azanylprop-1-ynyl)phenyl]-6,7-dimethoxy-4H-quinazolin-4-amine hydrochloride

Systemtic Name: 3-[2-(3-azanylprop-1-ynyl)phenyl]-6,7-dimethoxy-4H-quinazolin-4-amine hydrochloride Openeye Name: 3-[2-(3-aminoprop-1-ynyl)phenyl]-6,7-dimethoxy-4H-quinazolin-4-amine hydrochloride CAS Name: 3-[2-(3-aminoprop-1-ynyl)phenyl]-6,7-dimethoxy-4H-quinazolin-4-amine hydrochloride IUPAC Name: 3-[2-(3-aminoprop-1-ynyl)phenyl]-6,7-dimethoxy-4H-quinazolin-4-amine hydrochloride Traditional Name: 3-[2-(4-amino-6,7-dimethoxy-4H-quinazolin-3-yl)phenyl]prop-2-ynylamine hydrochloride Formula: C19H21ClN4O2 MolecularWeight: 372.84864

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(N(C=N2)C3=CC=CC=C3C#CCN)N)OC.Cl

Isomeric SMILES

COC1=C(C=C2C(=C1)C(N(C=N2)C3=CC=CC=C3C#CCN)N)OC.Cl

InChI

InChI=1S/C19H20N4O2.ClH/c1-24-17-10-14-15(11-18(17)25-2)22-12-23(19(14)21)16-8-4-3-6-13(16)7-5-9-20;/h3-4,6,8,10-12,19H,9,20-21H2,1-2H3;1H