2-(6-chloranyl-4-phenyl-quinazolin-2-yl)sulfanylethanenitrile

Systemtic Name: 2-(6-chloranyl-4-phenyl-quinazolin-2-yl)sulfanylethanenitrile Openeye Name: 2-(6-chloro-4-phenyl-quinazolin-2-yl)sulfanylacetonitrile CAS Name: 2-[(6-chloro-4-phenyl-2-quinazolinyl)thio]acetonitrile IUPAC Name: 2-(6-chloro-4-phenylquinazolin-2-yl)sulfanylacetonitrile Traditional Name: 2-[(6-chloro-4-phenyl-quinazolin-2-yl)thio]acetonitrile Formula: C16H10ClN3S MolecularWeight: 311.7887

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)Cl)SCC#N

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)Cl)SCC#N

InChI

InChI=1S/C16H10ClN3S/c17-12-6-7-14-13(10-12)15(11-4-2-1-3-5-11)20-16(19-14)21-9-8-18/h1-7,10H,9H2