2-[[2-(4-chlorophenyl)quinazolin-4-yl]amino]-4-methyl-phenol hydrochloride

Systemtic Name: 2-[[2-(4-chlorophenyl)quinazolin-4-yl]amino]-4-methyl-phenol hydrochloride Openeye Name: 2-[[2-(4-chlorophenyl)quinazolin-4-yl]amino]-4-methyl-phenol hydrochloride CAS Name: 2-[[2-(4-chlorophenyl)-4-quinazolinyl]amino]-4-methylphenol hydrochloride IUPAC Name: 2-[[2-(4-chlorophenyl)quinazolin-4-yl]amino]-4-methylphenol hydrochloride Traditional Name: 2-[[2-(4-chlorophenyl)quinazolin-4-yl]amino]-4-methyl-phenol hydrochloride Formula: C21H17Cl2N3O MolecularWeight: 398.28518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)NC2=NC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Cl.Cl

Isomeric SMILES

CC1=CC(=C(C=C1)O)NC2=NC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Cl.Cl

InChI

InChI=1S/C21H16ClN3O.ClH/c1-13-6-11-19(26)18(12-13)24-21-16-4-2-3-5-17(16)23-20(25-21)14-7-9-15(22)10-8-14;/h2-12,26H,1H3,(H,23,24,25);1H