2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(5-methyl-2-phenyl-pyrazol-3-yl)ethanamide

Systemtic Name: 2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(5-methyl-2-phenyl-pyrazol-3-yl)ethanamide Openeye Name: 2-(3-cyclopentyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(5-methyl-2-phenyl-pyrazol-3-yl)acetamide CAS Name: 2-[(3-cyclopentyl-4-oxo-2-quinazolinyl)thio]-N-(5-methyl-2-phenyl-3-pyrazolyl)acetamide IUPAC Name: 2-(3-cyclopentyl-4-oxoquinazolin-2-yl)sulfanyl-N-(5-methyl-2-phenylpyrazol-3-yl)acetamide Traditional Name: 2-[(3-cyclopentyl-4-keto-quinazolin-2-yl)thio]-N-(5-methyl-2-phenyl-pyrazol-3-yl)acetamide Formula: C25H25N5O2S MolecularWeight: 459.5633

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4CCCC4)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4CCCC4)C5=CC=CC=C5

InChI

InChI=1S/C25H25N5O2S/c1-17-15-22(30(28-17)19-11-3-2-4-12-19)27-23(31)16-33-25-26-21-14-8-7-13-20(21)24(32)29(25)18-9-5-6-10-18/h2-4,7-8,11-15,18H,5-6,9-10,16H2,1H3,(H,27,31)