[4-(quinazolin-4-ylamino)phenyl] thiocyanate

Systemtic Name: [4-(quinazolin-4-ylamino)phenyl] thiocyanate Openeye Name: [4-(quinazolin-4-ylamino)phenyl] thiocyanate CAS Name: thiocyanic acid [4-(4-quinazolinylamino)phenyl] ester IUPAC Name: [4-(quinazolin-4-ylamino)phenyl] thiocyanate Traditional Name: thiocyanic acid [4-(quinazolin-4-ylamino)phenyl] ester Formula: C15H10N4S MolecularWeight: 278.3317

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H10N4S/c16-9-20-12-7-5-11(6-8-12)19-15-13-3-1-2-4-14(13)17-10-18-15/h1-8,10H,(H,17,18,19)