(2R)-N-(1-cyanocyclohexyl)-2-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: (2R)-N-(1-cyanocyclohexyl)-2-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: (2R)-N-(1-cyanocyclohexyl)-2-(3-ethyl-4-oxo-quinazolin-2-yl)sulfanyl-propanamide CAS Name: (2R)-N-(1-cyanocyclohexyl)-2-[(3-ethyl-4-oxo-2-quinazolinyl)thio]propanamide IUPAC Name: (2R)-N-(1-cyanocyclohexyl)-2-(3-ethyl-4-oxoquinazolin-2-yl)sulfanylpropanamide Traditional Name: (2R)-N-(1-cyanocyclohexyl)-2-[(3-ethyl-4-keto-quinazolin-2-yl)thio]propionamide Formula: C20H24N4O2S MolecularWeight: 384.49516

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3(CCCCC3)C#N

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2N=C1S[C@H](C)C(=O)NC3(CCCCC3)C#N

InChI

InChI=1S/C20H24N4O2S/c1-3-24-18(26)15-9-5-6-10-16(15)22-19(24)27-14(2)17(25)23-20(13-21)11-7-4-8-12-20/h5-6,9-10,14H,3-4,7-8,11-12H2,1-2H3,(H,23,25)/t14-/m1/s1