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

Systemtic Name: N-(5-methyl-1H-pyrazol-3-yl)-2-[4-oxidanylidene-3-(1-phenylbutan-2-yl)quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: 2-[3-(1-benzylpropyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(5-methyl-1H-pyrazol-3-yl)acetamide CAS Name: N-(5-methyl-1H-pyrazol-3-yl)-2-[[4-oxo-3-(1-phenylbutan-2-yl)-2-quinazolinyl]thio]acetamide IUPAC Name: N-(5-methyl-1H-pyrazol-3-yl)-2-[4-oxo-3-(1-phenylbutan-2-yl)quinazolin-2-yl]sulfanylacetamide Traditional Name: 2-[[3-(1-benzylpropyl)-4-keto-quinazolin-2-yl]thio]-N-(5-methyl-1H-pyrazol-3-yl)acetamide Formula: C24H25N5O2S MolecularWeight: 447.5526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC=CC=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=NNC(=C4)C

Isomeric SMILES

CCC(CC1=CC=CC=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=NNC(=C4)C

InChI

InChI=1S/C24H25N5O2S/c1-3-18(14-17-9-5-4-6-10-17)29-23(31)19-11-7-8-12-20(19)25-24(29)32-15-22(30)26-21-13-16(2)27-28-21/h4-13,18H,3,14-15H2,1-2H3,(H2,26,27,28,30)