2-[6-methoxy-4-[(4-methoxyphenyl)amino]quinazolin-2-yl]sulfanylethanol hydrochloride

Systemtic Name: 2-[6-methoxy-4-[(4-methoxyphenyl)amino]quinazolin-2-yl]sulfanylethanol hydrochloride Openeye Name: 2-[6-methoxy-4-(4-methoxyanilino)quinazolin-2-yl]sulfanylethanol hydrochloride CAS Name: 2-[[6-methoxy-4-(4-methoxyanilino)-2-quinazolinyl]thio]ethanol hydrochloride IUPAC Name: 2-[6-methoxy-4-(4-methoxyanilino)quinazolin-2-yl]sulfanylethanol hydrochloride Traditional Name: 2-[[6-methoxy-4-(p-anisidino)quinazolin-2-yl]thio]ethanol hydrochloride Formula: C18H20ClN3O3S MolecularWeight: 393.8877

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=NC(=NC3=C2C=C(C=C3)OC)SCCO.Cl

Isomeric SMILES

COC1=CC=C(C=C1)NC2=NC(=NC3=C2C=C(C=C3)OC)SCCO.Cl

InChI

InChI=1S/C18H19N3O3S.ClH/c1-23-13-5-3-12(4-6-13)19-17-15-11-14(24-2)7-8-16(15)20-18(21-17)25-10-9-22;/h3-8,11,22H,9-10H2,1-2H3,(H,19,20,21);1H