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

Systemtic Name: N-(5-methyl-1,2-oxazol-3-yl)-2-[3-(3-methylpyridin-2-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-butanamide Openeye Name: N-(5-methylisoxazol-3-yl)-2-[3-(3-methyl-2-pyridyl)-4-oxo-quinazolin-2-yl]sulfanyl-butanamide CAS Name: N-(5-methyl-3-isoxazolyl)-2-[[3-(3-methyl-2-pyridinyl)-4-oxo-2-quinazolinyl]thio]butanamide IUPAC Name: N-(5-methyl-1,2-oxazol-3-yl)-2-[3-(3-methylpyridin-2-yl)-4-oxoquinazolin-2-yl]sulfanylbutanamide Traditional Name: 2-[[4-keto-3-(3-methyl-2-pyridyl)quinazolin-2-yl]thio]-N-(5-methylisoxazol-3-yl)butyramide Formula: C22H21N5O3S MolecularWeight: 435.49884

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NOC(=C1)C)SC2=NC3=CC=CC=C3C(=O)N2C4=C(C=CC=N4)C

Isomeric SMILES

CCC(C(=O)NC1=NOC(=C1)C)SC2=NC3=CC=CC=C3C(=O)N2C4=C(C=CC=N4)C

InChI

InChI=1S/C22H21N5O3S/c1-4-17(20(28)25-18-12-14(3)30-26-18)31-22-24-16-10-6-5-9-15(16)21(29)27(22)19-13(2)8-7-11-23-19/h5-12,17H,4H2,1-3H3,(H,25,26,28)