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

Systemtic Name: N-(1-cyanocyclohexyl)-2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: N-(1-cyanocyclohexyl)-2-(3-methyl-4-oxo-quinazolin-2-yl)sulfanyl-propanamide CAS Name: N-(1-cyanocyclohexyl)-2-[(3-methyl-4-oxo-2-quinazolinyl)thio]propanamide IUPAC Name: N-(1-cyanocyclohexyl)-2-(3-methyl-4-oxoquinazolin-2-yl)sulfanylpropanamide Traditional Name: N-(1-cyanocyclohexyl)-2-[(4-keto-3-methyl-quinazolin-2-yl)thio]propionamide Formula: C19H22N4O2S MolecularWeight: 370.46858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1(CCCCC1)C#N)SC2=NC3=CC=CC=C3C(=O)N2C

Isomeric SMILES

CC(C(=O)NC1(CCCCC1)C#N)SC2=NC3=CC=CC=C3C(=O)N2C

InChI

InChI=1S/C19H22N4O2S/c1-13(16(24)22-19(12-20)10-6-3-7-11-19)26-18-21-15-9-5-4-8-14(15)17(25)23(18)2/h4-5,8-9,13H,3,6-7,10-11H2,1-2H3,(H,22,24)