(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 4H-thieno[3,2-c]chromene-2-carboxylate

Systemtic Name: (7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 4H-thieno[3,2-c]chromene-2-carboxylate Openeye Name: (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl 4H-thieno[3,2-c]chromene-2-carboxylate CAS Name: 4H-thieno[3,2-c][1]benzopyran-2-carboxylic acid (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl 4H-thieno[3,2-c]chromene-2-carboxylate Traditional Name: 4H-thieno[3,2-c]chromene-2-carboxylic acid (7-chloro-4-keto-1H-quinazolin-2-yl)methyl ester Formula: C21H13ClN2O4S MolecularWeight: 424.85692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C3=CC=CC=C3O1)SC(=C2)C(=O)OCC4=NC(=O)C5=C(N4)C=C(C=C5)Cl

Isomeric SMILES

C1C2=C(C3=CC=CC=C3O1)SC(=C2)C(=O)OCC4=NC(=O)C5=C(N4)C=C(C=C5)Cl

InChI

InChI=1S/C21H13ClN2O4S/c22-12-5-6-13-15(8-12)23-18(24-20(13)25)10-28-21(26)17-7-11-9-27-16-4-2-1-3-14(16)19(11)29-17/h1-8H,9-10H2,(H,23,24,25)