3-(4,6-dimethylquinazolin-2-yl)sulfanylpropanenitrile

Systemtic Name: 3-(4,6-dimethylquinazolin-2-yl)sulfanylpropanenitrile Openeye Name: 3-(4,6-dimethylquinazolin-2-yl)sulfanylpropanenitrile CAS Name: 3-[(4,6-dimethyl-2-quinazolinyl)thio]propanenitrile IUPAC Name: 3-(4,6-dimethylquinazolin-2-yl)sulfanylpropanenitrile Traditional Name: 3-[(4,6-dimethylquinazolin-2-yl)thio]propionitrile Formula: C13H13N3S MolecularWeight: 243.32742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N=C2C)SCCC#N

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N=C2C)SCCC#N

InChI

InChI=1S/C13H13N3S/c1-9-4-5-12-11(8-9)10(2)15-13(16-12)17-7-3-6-14/h4-5,8H,3,7H2,1-2H3