2-[4-(2-methylquinazolin-4-yl)sulfanylphenyl]benzenecarbonitrile

Systemtic Name: 2-[4-(2-methylquinazolin-4-yl)sulfanylphenyl]benzenecarbonitrile Openeye Name: 2-[4-(2-methylquinazolin-4-yl)sulfanylphenyl]benzonitrile CAS Name: 2-[4-[(2-methyl-4-quinazolinyl)thio]phenyl]benzonitrile IUPAC Name: 2-[4-(2-methylquinazolin-4-yl)sulfanylphenyl]benzonitrile Traditional Name: 2-[4-[(2-methylquinazolin-4-yl)thio]phenyl]benzonitrile Formula: C22H15N3S MolecularWeight: 353.4396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=N1)SC3=CC=C(C=C3)C4=CC=CC=C4C#N

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=N1)SC3=CC=C(C=C3)C4=CC=CC=C4C#N

InChI

InChI=1S/C22H15N3S/c1-15-24-21-9-5-4-8-20(21)22(25-15)26-18-12-10-16(11-13-18)19-7-3-2-6-17(19)14-23/h2-13H,1H3