N-(5-chloranylpyridin-2-yl)-2-[4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(5-chloranylpyridin-2-yl)-2-[4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: 2-(3-benzyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(5-chloro-2-pyridyl)acetamide CAS Name: N-(5-chloro-2-pyridinyl)-2-[[4-oxo-3-(phenylmethyl)-2-quinazolinyl]thio]acetamide IUPAC Name: 2-(3-benzyl-4-oxoquinazolin-2-yl)sulfanyl-N-(5-chloropyridin-2-yl)acetamide Traditional Name: 2-[(3-benzyl-4-keto-quinazolin-2-yl)thio]-N-(5-chloro-2-pyridyl)acetamide Formula: C22H17ClN4O2S MolecularWeight: 436.91398

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=NC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=NC=C(C=C4)Cl

InChI

InChI=1S/C22H17ClN4O2S/c23-16-10-11-19(24-12-16)26-20(28)14-30-22-25-18-9-5-4-8-17(18)21(29)27(22)13-15-6-2-1-3-7-15/h1-12H,13-14H2,(H,24,26,28)