N-(5-chloranylpyridin-2-yl)-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(5-chloranylpyridin-2-yl)-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: 2-(3-allyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(5-chloro-2-pyridyl)acetamide CAS Name: N-(5-chloro-2-pyridinyl)-2-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]acetamide IUPAC Name: N-(5-chloropyridin-2-yl)-2-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylacetamide Traditional Name: 2-[(3-allyl-4-keto-quinazolin-2-yl)thio]-N-(5-chloro-2-pyridyl)acetamide Formula: C18H15ClN4O2S MolecularWeight: 386.8553

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=NC=C(C=C3)Cl

Isomeric SMILES

C=CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=NC=C(C=C3)Cl

InChI

InChI=1S/C18H15ClN4O2S/c1-2-9-23-17(25)13-5-3-4-6-14(13)21-18(23)26-11-16(24)22-15-8-7-12(19)10-20-15/h2-8,10H,1,9,11H2,(H,20,22,24)