(2R)-N-(4-acetamidophenyl)-2-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: (2R)-N-(4-acetamidophenyl)-2-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: (2R)-N-(4-acetamidophenyl)-2-(3-ethyl-4-oxo-quinazolin-2-yl)sulfanyl-propanamide CAS Name: (2R)-N-(4-acetamidophenyl)-2-[(3-ethyl-4-oxo-2-quinazolinyl)thio]propanamide IUPAC Name: (2R)-N-(4-acetamidophenyl)-2-(3-ethyl-4-oxoquinazolin-2-yl)sulfanylpropanamide Traditional Name: (2R)-N-(4-acetamidophenyl)-2-[(3-ethyl-4-keto-quinazolin-2-yl)thio]propionamide Formula: C21H22N4O3S MolecularWeight: 410.48938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2N=C1S[C@H](C)C(=O)NC3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C21H22N4O3S/c1-4-25-20(28)17-7-5-6-8-18(17)24-21(25)29-13(2)19(27)23-16-11-9-15(10-12-16)22-14(3)26/h5-13H,4H2,1-3H3,(H,22,26)(H,23,27)/t13-/m1/s1