N-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanamide

Systemtic Name: N-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Openeye Name: N-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-(4-oxo-2-thioxo-1H-quinazolin-3-yl)propanamide CAS Name: N-[4-(2-oxo-1-pyrrolidinyl)phenyl]-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide IUPAC Name: N-[4-(2-oxopyrrolidin-1-yl)phenyl]-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Traditional Name: N-[4-(2-ketopyrrolidino)phenyl]-3-(4-keto-2-thioxo-1H-quinazolin-3-yl)propionamide Formula: C21H20N4O3S MolecularWeight: 408.4735

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)NC(=O)CCN3C(=O)C4=CC=CC=C4NC3=S

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)NC(=O)CCN3C(=O)C4=CC=CC=C4NC3=S

InChI

InChI=1S/C21H20N4O3S/c26-18(22-14-7-9-15(10-8-14)24-12-3-6-19(24)27)11-13-25-20(28)16-4-1-2-5-17(16)23-21(25)29/h1-2,4-5,7-10H,3,6,11-13H2,(H,22,26)(H,23,29)