N-(5-methyl-2-phenyl-pyrazol-3-yl)-2-[3-(1-oxidanylbutan-2-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(5-methyl-2-phenyl-pyrazol-3-yl)-2-[3-(1-oxidanylbutan-2-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: 2-[3-[1-(hydroxymethyl)propyl]-4-oxo-quinazolin-2-yl]sulfanyl-N-(5-methyl-2-phenyl-pyrazol-3-yl)acetamide CAS Name: 2-[[3-(1-hydroxybutan-2-yl)-4-oxo-2-quinazolinyl]thio]-N-(5-methyl-2-phenyl-3-pyrazolyl)acetamide IUPAC Name: 2-[3-(1-hydroxybutan-2-yl)-4-oxoquinazolin-2-yl]sulfanyl-N-(5-methyl-2-phenylpyrazol-3-yl)acetamide Traditional Name: 2-[[4-keto-3-(1-methylolpropyl)quinazolin-2-yl]thio]-N-(5-methyl-2-phenyl-pyrazol-3-yl)acetamide Formula: C24H25N5O3S MolecularWeight: 463.552

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC(=NN3C4=CC=CC=C4)C

Isomeric SMILES

CCC(CO)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC(=NN3C4=CC=CC=C4)C

InChI

InChI=1S/C24H25N5O3S/c1-3-17(14-30)28-23(32)19-11-7-8-12-20(19)25-24(28)33-15-22(31)26-21-13-16(2)27-29(21)18-9-5-4-6-10-18/h4-13,17,30H,3,14-15H2,1-2H3,(H,26,31)