N-(5-methyl-2-phenyl-pyrazol-3-yl)-2-(2-methylquinazolin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(5-methyl-2-phenyl-pyrazol-3-yl)-2-(2-methylquinazolin-4-yl)sulfanyl-ethanamide Openeye Name: N-(5-methyl-2-phenyl-pyrazol-3-yl)-2-(2-methylquinazolin-4-yl)sulfanyl-acetamide CAS Name: N-(5-methyl-2-phenyl-3-pyrazolyl)-2-[(2-methyl-4-quinazolinyl)thio]acetamide IUPAC Name: N-(5-methyl-2-phenylpyrazol-3-yl)-2-(2-methylquinazolin-4-yl)sulfanylacetamide Traditional Name: N-(5-methyl-2-phenyl-pyrazol-3-yl)-2-[(2-methylquinazolin-4-yl)thio]acetamide Formula: C21H19N5OS MolecularWeight: 389.47346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)CSC2=NC(=NC3=CC=CC=C32)C)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)CSC2=NC(=NC3=CC=CC=C32)C)C4=CC=CC=C4

InChI

InChI=1S/C21H19N5OS/c1-14-12-19(26(25-14)16-8-4-3-5-9-16)24-20(27)13-28-21-17-10-6-7-11-18(17)22-15(2)23-21/h3-12H,13H2,1-2H3,(H,24,27)