N2-(3,5-dimethylphenyl)-N4-(oxolan-2-ylmethyl)quinazoline-2,4-diamine hydrochloride

Systemtic Name: N2-(3,5-dimethylphenyl)-N4-(oxolan-2-ylmethyl)quinazoline-2,4-diamine hydrochloride Openeye Name: N2-(3,5-dimethylphenyl)-N4-(tetrahydrofuran-2-ylmethyl)quinazoline-2,4-diamine hydrochloride CAS Name: N2-(3,5-dimethylphenyl)-N4-(2-oxolanylmethyl)quinazoline-2,4-diamine hydrochloride IUPAC Name: 2-N-(3,5-dimethylphenyl)-4-N-(oxolan-2-ylmethyl)quinazoline-2,4-diamine hydrochloride Traditional Name: [2-(3,5-dimethylanilino)quinazolin-4-yl]-(tetrahydrofurfuryl)amine hydrochloride Formula: C21H25ClN4O MolecularWeight: 384.9024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC2=NC3=CC=CC=C3C(=N2)NCC4CCCO4)C.Cl

Isomeric SMILES

CC1=CC(=CC(=C1)NC2=NC3=CC=CC=C3C(=N2)NCC4CCCO4)C.Cl

InChI

InChI=1S/C21H24N4O.ClH/c1-14-10-15(2)12-16(11-14)23-21-24-19-8-4-3-7-18(19)20(25-21)22-13-17-6-5-9-26-17;/h3-4,7-8,10-12,17H,5-6,9,13H2,1-2H3,(H2,22,23,24,25);1H