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

Systemtic Name: 2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]ethanamide Openeye Name: 2-(3-butyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]acetamide CAS Name: 2-[(3-butyl-4-oxo-2-quinazolinyl)thio]-N-[3-(3,5-dimethyl-1-pyrazolyl)propyl]acetamide IUPAC Name: 2-(3-butyl-4-oxoquinazolin-2-yl)sulfanyl-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]acetamide Traditional Name: 2-[(3-butyl-4-keto-quinazolin-2-yl)thio]-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]acetamide Formula: C22H29N5O2S MolecularWeight: 427.56296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCCCN3C(=CC(=N3)C)C

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCCCN3C(=CC(=N3)C)C

InChI

InChI=1S/C22H29N5O2S/c1-4-5-12-26-21(29)18-9-6-7-10-19(18)24-22(26)30-15-20(28)23-11-8-13-27-17(3)14-16(2)25-27/h6-7,9-10,14H,4-5,8,11-13,15H2,1-3H3,(H,23,28)