2-[7-chloranyl-3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(2-cyanophenyl)carbamoyl]ethanamide

Systemtic Name: 2-[7-chloranyl-3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(2-cyanophenyl)carbamoyl]ethanamide Openeye Name: 2-[7-chloro-3-(2-methoxyethyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-[(2-cyanophenyl)carbamoyl]acetamide CAS Name: 2-[[7-chloro-3-(2-methoxyethyl)-4-oxo-2-quinazolinyl]thio]-N-[(2-cyanoanilino)-oxomethyl]acetamide IUPAC Name: 2-[7-chloro-3-(2-methoxyethyl)-4-oxoquinazolin-2-yl]sulfanyl-N-[(2-cyanophenyl)carbamoyl]acetamide Traditional Name: 2-[[7-chloro-4-keto-3-(2-methoxyethyl)quinazolin-2-yl]thio]-N-[(2-cyanophenyl)carbamoyl]acetamide Formula: C21H18ClN5O4S MolecularWeight: 471.91672

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)NC(=O)NC3=CC=CC=C3C#N

Isomeric SMILES

COCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)NC(=O)NC3=CC=CC=C3C#N

InChI

InChI=1S/C21H18ClN5O4S/c1-31-9-8-27-19(29)15-7-6-14(22)10-17(15)25-21(27)32-12-18(28)26-20(30)24-16-5-3-2-4-13(16)11-23/h2-7,10H,8-9,12H2,1H3,(H2,24,26,28,30)