[3-(2-chloranyl-8-methyl-quinolin-3-yl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-thiophen-2-yl-methanone

Systemtic Name: [3-(2-chloranyl-8-methyl-quinolin-3-yl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-thiophen-2-yl-methanone Openeye Name: [3-(2-chloro-8-methyl-3-quinolyl)-5-(p-tolyl)-3,4-dihydropyrazol-2-yl]-(2-thienyl)methanone CAS Name: [3-(2-chloro-8-methyl-3-quinolinyl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-thiophen-2-ylmethanone IUPAC Name: [3-(2-chloro-8-methylquinolin-3-yl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-thiophen-2-ylmethanone Traditional Name: [5-(2-chloro-8-methyl-3-quinolyl)-3-(p-tolyl)-2-pyrazolin-1-yl]-(2-thienyl)methanone Formula: C25H20ClN3OS MolecularWeight: 445.9638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(C2)C3=C(N=C4C(=CC=CC4=C3)C)Cl)C(=O)C5=CC=CS5

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(C2)C3=C(N=C4C(=CC=CC4=C3)C)Cl)C(=O)C5=CC=CS5

InChI

InChI=1S/C25H20ClN3OS/c1-15-8-10-17(11-9-15)20-14-21(29(28-20)25(30)22-7-4-12-31-22)19-13-18-6-3-5-16(2)23(18)27-24(19)26/h3-13,21H,14H2,1-2H3