N-[2-(2,6-dimethylphenoxy)ethyl]-3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanamide

Systemtic Name: N-[2-(2,6-dimethylphenoxy)ethyl]-3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Openeye Name: N-[2-(2,6-dimethylphenoxy)ethyl]-3-(4-oxo-2-thioxo-1H-quinazolin-3-yl)propanamide CAS Name: N-[2-(2,6-dimethylphenoxy)ethyl]-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide IUPAC Name: N-[2-(2,6-dimethylphenoxy)ethyl]-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Traditional Name: N-[2-(2,6-dimethylphenoxy)ethyl]-3-(4-keto-2-thioxo-1H-quinazolin-3-yl)propionamide Formula: C21H23N3O3S MolecularWeight: 397.49062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCCNC(=O)CCN2C(=O)C3=CC=CC=C3NC2=S

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCCNC(=O)CCN2C(=O)C3=CC=CC=C3NC2=S

InChI

InChI=1S/C21H23N3O3S/c1-14-6-5-7-15(2)19(14)27-13-11-22-18(25)10-12-24-20(26)16-8-3-4-9-17(16)23-21(24)28/h3-9H,10-13H2,1-2H3,(H,22,25)(H,23,28)