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

Systemtic Name: 2-(3-cyclohexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(5-methyl-2-phenyl-pyrazol-3-yl)ethanamide Openeye Name: 2-(3-cyclohexyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(5-methyl-2-phenyl-pyrazol-3-yl)acetamide CAS Name: 2-[(3-cyclohexyl-4-oxo-2-quinazolinyl)thio]-N-(5-methyl-2-phenyl-3-pyrazolyl)acetamide IUPAC Name: 2-(3-cyclohexyl-4-oxoquinazolin-2-yl)sulfanyl-N-(5-methyl-2-phenylpyrazol-3-yl)acetamide Traditional Name: 2-[(3-cyclohexyl-4-keto-quinazolin-2-yl)thio]-N-(5-methyl-2-phenyl-pyrazol-3-yl)acetamide Formula: C26H27N5O2S MolecularWeight: 473.58988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4CCCCC4)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4CCCCC4)C5=CC=CC=C5

InChI

InChI=1S/C26H27N5O2S/c1-18-16-23(31(29-18)20-12-6-3-7-13-20)28-24(32)17-34-26-27-22-15-9-8-14-21(22)25(33)30(26)19-10-4-2-5-11-19/h3,6-9,12-16,19H,2,4-5,10-11,17H2,1H3,(H,28,32)