N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-quinazolin-4-ylsulfanyl-ethanamide

Systemtic Name: N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-quinazolin-4-ylsulfanyl-ethanamide Openeye Name: N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-quinazolin-4-ylsulfanyl-acetamide CAS Name: N-(5-tert-butyl-2-phenyl-3-pyrazolyl)-2-(4-quinazolinylthio)acetamide IUPAC Name: N-(5-tert-butyl-2-phenylpyrazol-3-yl)-2-quinazolin-4-ylsulfanylacetamide Traditional Name: N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-(quinazolin-4-ylthio)acetamide Formula: C23H23N5OS MolecularWeight: 417.52662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)CSC2=NC=NC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)CSC2=NC=NC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C23H23N5OS/c1-23(2,3)19-13-20(28(27-19)16-9-5-4-6-10-16)26-21(29)14-30-22-17-11-7-8-12-18(17)24-15-25-22/h4-13,15H,14H2,1-3H3,(H,26,29)