2-[4-oxidanylidene-3-(3-phenylpropyl)quinazolin-2-yl]sulfanyl-N-(2-propan-2-ylpyrazol-3-yl)ethanamide

Systemtic Name: 2-[4-oxidanylidene-3-(3-phenylpropyl)quinazolin-2-yl]sulfanyl-N-(2-propan-2-ylpyrazol-3-yl)ethanamide Openeye Name: N-(2-isopropylpyrazol-3-yl)-2-[4-oxo-3-(3-phenylpropyl)quinazolin-2-yl]sulfanyl-acetamide CAS Name: 2-[[4-oxo-3-(3-phenylpropyl)-2-quinazolinyl]thio]-N-(2-propan-2-yl-3-pyrazolyl)acetamide IUPAC Name: 2-[4-oxo-3-(3-phenylpropyl)quinazolin-2-yl]sulfanyl-N-(2-propan-2-ylpyrazol-3-yl)acetamide Traditional Name: N-(2-isopropylpyrazol-3-yl)-2-[[4-keto-3-(3-phenylpropyl)quinazolin-2-yl]thio]acetamide Formula: C25H27N5O2S MolecularWeight: 461.57918

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=CC=N1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCCC4=CC=CC=C4

Isomeric SMILES

CC(C)N1C(=CC=N1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCCC4=CC=CC=C4

InChI

InChI=1S/C25H27N5O2S/c1-18(2)30-22(14-15-26-30)28-23(31)17-33-25-27-21-13-7-6-12-20(21)24(32)29(25)16-8-11-19-9-4-3-5-10-19/h3-7,9-10,12-15,18H,8,11,16-17H2,1-2H3,(H,28,31)