2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]ethanamide

Systemtic Name: 2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]ethanamide Openeye Name: 2-(3-cyclopropyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]acetamide CAS Name: 2-[(3-cyclopropyl-4-oxo-2-quinazolinyl)thio]-N-[3-(3,5-dimethyl-1-pyrazolyl)propyl]acetamide IUPAC Name: 2-(3-cyclopropyl-4-oxoquinazolin-2-yl)sulfanyl-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]acetamide Traditional Name: 2-[(3-cyclopropyl-4-keto-quinazolin-2-yl)thio]-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]acetamide Formula: C21H25N5O2S MolecularWeight: 411.5205

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCCNC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4CC4)C

Isomeric SMILES

CC1=CC(=NN1CCCNC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4CC4)C

InChI

InChI=1S/C21H25N5O2S/c1-14-12-15(2)25(24-14)11-5-10-22-19(27)13-29-21-23-18-7-4-3-6-17(18)20(28)26(21)16-8-9-16/h3-4,6-7,12,16H,5,8-11,13H2,1-2H3,(H,22,27)