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

Systemtic Name: (2R)-N-(2-cyanophenyl)-2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: (2R)-N-(2-cyanophenyl)-2-(3-hexyl-4-oxo-quinazolin-2-yl)sulfanyl-propanamide CAS Name: (2R)-N-(2-cyanophenyl)-2-[(3-hexyl-4-oxo-2-quinazolinyl)thio]propanamide IUPAC Name: (2R)-N-(2-cyanophenyl)-2-(3-hexyl-4-oxoquinazolin-2-yl)sulfanylpropanamide Traditional Name: (2R)-N-(2-cyanophenyl)-2-[(3-hexyl-4-keto-quinazolin-2-yl)thio]propionamide Formula: C24H26N4O2S MolecularWeight: 434.55384

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3=CC=CC=C3C#N

Isomeric SMILES

CCCCCCN1C(=O)C2=CC=CC=C2N=C1S[C@H](C)C(=O)NC3=CC=CC=C3C#N

InChI

InChI=1S/C24H26N4O2S/c1-3-4-5-10-15-28-23(30)19-12-7-9-14-21(19)27-24(28)31-17(2)22(29)26-20-13-8-6-11-18(20)16-25/h6-9,11-14,17H,3-5,10,15H2,1-2H3,(H,26,29)/t17-/m1/s1