2-(2-methylquinazolin-4-yl)sulfanyl-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone

Systemtic Name: 2-(2-methylquinazolin-4-yl)sulfanyl-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone Openeye Name: 2-(2-methylquinazolin-4-yl)sulfanyl-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone CAS Name: 2-[(2-methyl-4-quinazolinyl)thio]-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone IUPAC Name: 2-(2-methylquinazolin-4-yl)sulfanyl-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone Traditional Name: 2-[(2-methylquinazolin-4-yl)thio]-1-(3-phenyl-2-pyrazolin-1-yl)ethanone Formula: C20H18N4OS MolecularWeight: 362.44812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=N1)SCC(=O)N3CCC(=N3)C4=CC=CC=C4

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=N1)SCC(=O)N3CCC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C20H18N4OS/c1-14-21-18-10-6-5-9-16(18)20(22-14)26-13-19(25)24-12-11-17(23-24)15-7-3-2-4-8-15/h2-10H,11-13H2,1H3