3-[3-[(2-chlorophenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanenitrile

Systemtic Name: 3-[3-[(2-chlorophenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanenitrile Openeye Name: 3-[3-[(2-chlorophenyl)methyl]-4-oxo-quinazolin-2-yl]sulfanylpropanenitrile CAS Name: 3-[[3-[(2-chlorophenyl)methyl]-4-oxo-2-quinazolinyl]thio]propanenitrile IUPAC Name: 3-[3-[(2-chlorophenyl)methyl]-4-oxoquinazolin-2-yl]sulfanylpropanenitrile Traditional Name: 3-[[3-(2-chlorobenzyl)-4-keto-quinazolin-2-yl]thio]propionitrile Formula: C18H14ClN3OS MolecularWeight: 355.84126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C(=O)C3=CC=CC=C3N=C2SCCC#N)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CN2C(=O)C3=CC=CC=C3N=C2SCCC#N)Cl

InChI

InChI=1S/C18H14ClN3OS/c19-15-8-3-1-6-13(15)12-22-17(23)14-7-2-4-9-16(14)21-18(22)24-11-5-10-20/h1-4,6-9H,5,11-12H2