2-[3-(2-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)butanamide

Systemtic Name: 2-[3-(2-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)butanamide Openeye Name: 2-[3-(2-chlorophenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(5-methylisoxazol-3-yl)butanamide CAS Name: 2-[[3-(2-chlorophenyl)-4-oxo-2-quinazolinyl]thio]-N-(5-methyl-3-isoxazolyl)butanamide IUPAC Name: 2-[3-(2-chlorophenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)butanamide Traditional Name: 2-[[3-(2-chlorophenyl)-4-keto-quinazolin-2-yl]thio]-N-(5-methylisoxazol-3-yl)butyramide Formula: C22H19ClN4O3S MolecularWeight: 454.92926

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NOC(=C1)C)SC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4Cl

Isomeric SMILES

CCC(C(=O)NC1=NOC(=C1)C)SC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4Cl

InChI

InChI=1S/C22H19ClN4O3S/c1-3-18(20(28)25-19-12-13(2)30-26-19)31-22-24-16-10-6-4-8-14(16)21(29)27(22)17-11-7-5-9-15(17)23/h4-12,18H,3H2,1-2H3,(H,25,26,28)