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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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