3-(3,5-dimethylpyrazol-1-yl)-N-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanamide

Systemtic Name: 3-(3,5-dimethylpyrazol-1-yl)-N-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Openeye Name: 3-(3,5-dimethylpyrazol-1-yl)-N-(4-oxo-2-thioxo-1H-quinazolin-3-yl)propanamide CAS Name: 3-(3,5-dimethyl-1-pyrazolyl)-N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide IUPAC Name: 3-(3,5-dimethylpyrazol-1-yl)-N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Traditional Name: 3-(3,5-dimethylpyrazol-1-yl)-N-(4-keto-2-thioxo-1H-quinazolin-3-yl)propionamide Formula: C16H17N5O2S MolecularWeight: 343.40348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCC(=O)NN2C(=O)C3=CC=CC=C3NC2=S)C

Isomeric SMILES

CC1=CC(=NN1CCC(=O)NN2C(=O)C3=CC=CC=C3NC2=S)C

InChI

InChI=1S/C16H17N5O2S/c1-10-9-11(2)20(18-10)8-7-14(22)19-21-15(23)12-5-3-4-6-13(12)17-16(21)24/h3-6,9H,7-8H2,1-2H3,(H,17,24)(H,19,22)