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

Systemtic Name: 2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(1-cyanocyclohexyl)propanamide Openeye Name: 2-(3-butyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(1-cyanocyclohexyl)propanamide CAS Name: 2-[(3-butyl-4-oxo-2-quinazolinyl)thio]-N-(1-cyanocyclohexyl)propanamide IUPAC Name: 2-(3-butyl-4-oxoquinazolin-2-yl)sulfanyl-N-(1-cyanocyclohexyl)propanamide Traditional Name: 2-[(3-butyl-4-keto-quinazolin-2-yl)thio]-N-(1-cyanocyclohexyl)propionamide Formula: C22H28N4O2S MolecularWeight: 412.54832

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3(CCCCC3)C#N

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3(CCCCC3)C#N

InChI

InChI=1S/C22H28N4O2S/c1-3-4-14-26-20(28)17-10-6-7-11-18(17)24-21(26)29-16(2)19(27)25-22(15-23)12-8-5-9-13-22/h6-7,10-11,16H,3-5,8-9,12-14H2,1-2H3,(H,25,27)