2-[3-[(2-chlorophenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-cyclopentylpyrazol-3-yl)ethanamide

Systemtic Name: 2-[3-[(2-chlorophenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-cyclopentylpyrazol-3-yl)ethanamide Openeye Name: 2-[3-[(2-chlorophenyl)methyl]-4-oxo-quinazolin-2-yl]sulfanyl-N-(2-cyclopentylpyrazol-3-yl)acetamide CAS Name: 2-[[3-[(2-chlorophenyl)methyl]-4-oxo-2-quinazolinyl]thio]-N-(2-cyclopentyl-3-pyrazolyl)acetamide IUPAC Name: 2-[3-[(2-chlorophenyl)methyl]-4-oxoquinazolin-2-yl]sulfanyl-N-(2-cyclopentylpyrazol-3-yl)acetamide Traditional Name: 2-[[3-(2-chlorobenzyl)-4-keto-quinazolin-2-yl]thio]-N-(2-cyclopentylpyrazol-3-yl)acetamide Formula: C25H24ClN5O2S MolecularWeight: 494.00836

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=CC=N2)NC(=O)CSC3=NC4=CC=CC=C4C(=O)N3CC5=CC=CC=C5Cl

Isomeric SMILES

C1CCC(C1)N2C(=CC=N2)NC(=O)CSC3=NC4=CC=CC=C4C(=O)N3CC5=CC=CC=C5Cl

InChI

InChI=1S/C25H24ClN5O2S/c26-20-11-5-1-7-17(20)15-30-24(33)19-10-4-6-12-21(19)28-25(30)34-16-23(32)29-22-13-14-27-31(22)18-8-2-3-9-18/h1,4-7,10-14,18H,2-3,8-9,15-16H2,(H,29,32)