2-[7-chloranyl-3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(4,6-dimethoxypyrimidin-2-yl)ethanamide

Systemtic Name: 2-[7-chloranyl-3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(4,6-dimethoxypyrimidin-2-yl)ethanamide Openeye Name: 2-[7-chloro-3-(2-methoxyethyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(4,6-dimethoxypyrimidin-2-yl)acetamide CAS Name: 2-[[7-chloro-3-(2-methoxyethyl)-4-oxo-2-quinazolinyl]thio]-N-(4,6-dimethoxy-2-pyrimidinyl)acetamide IUPAC Name: 2-[7-chloro-3-(2-methoxyethyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(4,6-dimethoxypyrimidin-2-yl)acetamide Traditional Name: 2-[[7-chloro-4-keto-3-(2-methoxyethyl)quinazolin-2-yl]thio]-N-(4,6-dimethoxypyrimidin-2-yl)acetamide Formula: C19H20ClN5O5S MolecularWeight: 465.9106

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)NC3=NC(=CC(=N3)OC)OC

Isomeric SMILES

COCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)NC3=NC(=CC(=N3)OC)OC

InChI

InChI=1S/C19H20ClN5O5S/c1-28-7-6-25-17(27)12-5-4-11(20)8-13(12)21-19(25)31-10-14(26)22-18-23-15(29-2)9-16(24-18)30-3/h4-5,8-9H,6-7,10H2,1-3H3,(H,22,23,24,26)