3-pentyl-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-pentyl-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-pentyl-2-thioxo-1H-quinazolin-4-one CAS Name: 3-pentyl-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-pentyl-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-amyl-2-thioxo-1H-quinazolin-4-one Formula: C13H16N2OS MolecularWeight: 248.34394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2NC1=S

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2NC1=S

InChI

InChI=1S/C13H16N2OS/c1-2-3-6-9-15-12(16)10-7-4-5-8-11(10)14-13(15)17/h4-5,7-8H,2-3,6,9H2,1H3,(H,14,17)