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

Systemtic Name: N-(5-chloranylpyridin-2-yl)-2-[3-(5-methylpyridin-2-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide Openeye Name: N-(5-chloro-2-pyridyl)-2-[3-(5-methyl-2-pyridyl)-4-oxo-quinazolin-2-yl]sulfanyl-propanamide CAS Name: N-(5-chloro-2-pyridinyl)-2-[[3-(5-methyl-2-pyridinyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: N-(5-chloropyridin-2-yl)-2-[3-(5-methylpyridin-2-yl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: N-(5-chloro-2-pyridyl)-2-[[4-keto-3-(5-methyl-2-pyridyl)quinazolin-2-yl]thio]propionamide Formula: C22H18ClN5O2S MolecularWeight: 451.92862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NC4=NC=C(C=C4)Cl

Isomeric SMILES

CC1=CN=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NC4=NC=C(C=C4)Cl

InChI

InChI=1S/C22H18ClN5O2S/c1-13-7-10-19(25-11-13)28-21(30)16-5-3-4-6-17(16)26-22(28)31-14(2)20(29)27-18-9-8-15(23)12-24-18/h3-12,14H,1-2H3,(H,24,27,29)