[4-[(6,7-dimethoxyquinazolin-4-yl)amino]phenyl] thiocyanate

Systemtic Name: [4-[(6,7-dimethoxyquinazolin-4-yl)amino]phenyl] thiocyanate Openeye Name: [4-[(6,7-dimethoxyquinazolin-4-yl)amino]phenyl] thiocyanate CAS Name: thiocyanic acid [4-[(6,7-dimethoxy-4-quinazolinyl)amino]phenyl] ester IUPAC Name: [4-[(6,7-dimethoxyquinazolin-4-yl)amino]phenyl] thiocyanate Traditional Name: thiocyanic acid [4-[(6,7-dimethoxyquinazolin-4-yl)amino]phenyl] ester Formula: C17H14N4O2S MolecularWeight: 338.38366

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC=C(C=C3)SC#N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC=C(C=C3)SC#N)OC

InChI

InChI=1S/C17H14N4O2S/c1-22-15-7-13-14(8-16(15)23-2)19-10-20-17(13)21-11-3-5-12(6-4-11)24-9-18/h3-8,10H,1-2H3,(H,19,20,21)