2-(4-oxidanylidene-3-pyridin-3-yl-quinazolin-2-yl)sulfanyl-N-(prop-2-enylcarbamoyl)ethanamide

Systemtic Name: 2-(4-oxidanylidene-3-pyridin-3-yl-quinazolin-2-yl)sulfanyl-N-(prop-2-enylcarbamoyl)ethanamide Openeye Name: N-(allylcarbamoyl)-2-[4-oxo-3-(3-pyridyl)quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-[oxo-(prop-2-enylamino)methyl]-2-[[4-oxo-3-(3-pyridinyl)-2-quinazolinyl]thio]acetamide IUPAC Name: 2-(4-oxo-3-pyridin-3-ylquinazolin-2-yl)sulfanyl-N-(prop-2-enylcarbamoyl)acetamide Traditional Name: N-(allylcarbamoyl)-2-[[4-keto-3-(3-pyridyl)quinazolin-2-yl]thio]acetamide Formula: C19H17N5O3S MolecularWeight: 395.43498

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=CN=CC=C3

Isomeric SMILES

C=CCNC(=O)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=CN=CC=C3

InChI

InChI=1S/C19H17N5O3S/c1-2-9-21-18(27)23-16(25)12-28-19-22-15-8-4-3-7-14(15)17(26)24(19)13-6-5-10-20-11-13/h2-8,10-11H,1,9,12H2,(H2,21,23,25,27)