N-(5-chloranylpyridin-2-yl)-2-[4-oxidanylidene-3-(3-oxidanylpropyl)quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: N-(5-chloranylpyridin-2-yl)-2-[4-oxidanylidene-3-(3-oxidanylpropyl)quinazolin-2-yl]sulfanyl-propanamide Openeye Name: N-(5-chloro-2-pyridyl)-2-[3-(3-hydroxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-propanamide CAS Name: N-(5-chloro-2-pyridinyl)-2-[[3-(3-hydroxypropyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: N-(5-chloropyridin-2-yl)-2-[3-(3-hydroxypropyl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: N-(5-chloro-2-pyridyl)-2-[[3-(3-hydroxypropyl)-4-keto-quinazolin-2-yl]thio]propionamide Formula: C19H19ClN4O3S MolecularWeight: 418.89716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC=C(C=C1)Cl)SC2=NC3=CC=CC=C3C(=O)N2CCCO

Isomeric SMILES

CC(C(=O)NC1=NC=C(C=C1)Cl)SC2=NC3=CC=CC=C3C(=O)N2CCCO

InChI

InChI=1S/C19H19ClN4O3S/c1-12(17(26)23-16-8-7-13(20)11-21-16)28-19-22-15-6-3-2-5-14(15)18(27)24(19)9-4-10-25/h2-3,5-8,11-12,25H,4,9-10H2,1H3,(H,21,23,26)