[4-[(2-chloranylquinazolin-4-yl)amino]phenyl] thiocyanate

Systemtic Name: [4-[(2-chloranylquinazolin-4-yl)amino]phenyl] thiocyanate Openeye Name: [4-[(2-chloroquinazolin-4-yl)amino]phenyl] thiocyanate CAS Name: thiocyanic acid [4-[(2-chloro-4-quinazolinyl)amino]phenyl] ester IUPAC Name: [4-[(2-chloroquinazolin-4-yl)amino]phenyl] thiocyanate Traditional Name: thiocyanic acid [4-[(2-chloroquinazolin-4-yl)amino]phenyl] ester Formula: C15H9ClN4S MolecularWeight: 312.77676

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H9ClN4S/c16-15-19-13-4-2-1-3-12(13)14(20-15)18-10-5-7-11(8-6-10)21-9-17/h1-8H,(H,18,19,20)