2-[7-chloranyl-3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanenitrile

Systemtic Name: 2-[7-chloranyl-3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanenitrile Openeye Name: 2-[7-chloro-3-(2-furylmethyl)-4-oxo-quinazolin-2-yl]sulfanylacetonitrile CAS Name: 2-[[7-chloro-3-(2-furanylmethyl)-4-oxo-2-quinazolinyl]thio]acetonitrile IUPAC Name: 2-[7-chloro-3-(furan-2-ylmethyl)-4-oxoquinazolin-2-yl]sulfanylacetonitrile Traditional Name: 2-[[7-chloro-3-(2-furfuryl)-4-keto-quinazolin-2-yl]thio]acetonitrile Formula: C15H10ClN3O2S MolecularWeight: 331.7768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CN2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC#N

Isomeric SMILES

C1=COC(=C1)CN2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC#N

InChI

InChI=1S/C15H10ClN3O2S/c16-10-3-4-12-13(8-10)18-15(22-7-5-17)19(14(12)20)9-11-2-1-6-21-11/h1-4,6,8H,7,9H2