2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)ethanamide

Systemtic Name: 2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)ethanamide Openeye Name: 2-(3-allyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)acetamide CAS Name: 2-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]-N-(1,3,5-trimethyl-4-pyrazolyl)acetamide IUPAC Name: 2-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)acetamide Traditional Name: 2-[(3-allyl-4-keto-quinazolin-2-yl)thio]-N-(1,3,5-trimethylpyrazol-4-yl)acetamide Formula: C19H21N5O2S MolecularWeight: 383.46734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC=C

Isomeric SMILES

CC1=C(C(=NN1C)C)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC=C

InChI

InChI=1S/C19H21N5O2S/c1-5-10-24-18(26)14-8-6-7-9-15(14)20-19(24)27-11-16(25)21-17-12(2)22-23(4)13(17)3/h5-9H,1,10-11H2,2-4H3,(H,21,25)