(2S)-N-(ethylcarbamoyl)-2-(4-oxidanylidene-3-pyridin-3-yl-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: (2S)-N-(ethylcarbamoyl)-2-(4-oxidanylidene-3-pyridin-3-yl-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: (2S)-N-(ethylcarbamoyl)-2-[4-oxo-3-(3-pyridyl)quinazolin-2-yl]sulfanyl-propanamide CAS Name: (2S)-N-(ethylcarbamoyl)-2-[[4-oxo-3-(3-pyridinyl)-2-quinazolinyl]thio]propanamide IUPAC Name: (2S)-N-(ethylcarbamoyl)-2-(4-oxo-3-pyridin-3-ylquinazolin-2-yl)sulfanylpropanamide Traditional Name: (2S)-N-(ethylcarbamoyl)-2-[[4-keto-3-(3-pyridyl)quinazolin-2-yl]thio]propionamide Formula: C19H19N5O3S MolecularWeight: 397.45086

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)C(C)SC1=NC2=CC=CC=C2C(=O)N1C3=CN=CC=C3

Isomeric SMILES

CCNC(=O)NC(=O)[C@H](C)SC1=NC2=CC=CC=C2C(=O)N1C3=CN=CC=C3

InChI

InChI=1S/C19H19N5O3S/c1-3-21-18(27)23-16(25)12(2)28-19-22-15-9-5-4-8-14(15)17(26)24(19)13-7-6-10-20-11-13/h4-12H,3H2,1-2H3,(H2,21,23,25,27)/t12-/m0/s1