(2R)-N-(4-cyanophenyl)-2-(4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: (2R)-N-(4-cyanophenyl)-2-(4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: (2R)-N-(4-cyanophenyl)-2-(4-oxo-3-propyl-quinazolin-2-yl)sulfanyl-propanamide CAS Name: (2R)-N-(4-cyanophenyl)-2-[(4-oxo-3-propyl-2-quinazolinyl)thio]propanamide IUPAC Name: (2R)-N-(4-cyanophenyl)-2-(4-oxo-3-propylquinazolin-2-yl)sulfanylpropanamide Traditional Name: (2R)-N-(4-cyanophenyl)-2-[(4-keto-3-propyl-quinazolin-2-yl)thio]propionamide Formula: C21H20N4O2S MolecularWeight: 392.4741

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3=CC=C(C=C3)C#N

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2N=C1S[C@H](C)C(=O)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H20N4O2S/c1-3-12-25-20(27)17-6-4-5-7-18(17)24-21(25)28-14(2)19(26)23-16-10-8-15(13-22)9-11-16/h4-11,14H,3,12H2,1-2H3,(H,23,26)/t14-/m1/s1