[3-(2-chloranyl-6-ethoxy-quinolin-3-yl)-5-(4-methylphenyl)-1,3-dihydropyrazol-2-yl]-thiophen-2-yl-methanone

Systemtic Name: [3-(2-chloranyl-6-ethoxy-quinolin-3-yl)-5-(4-methylphenyl)-1,3-dihydropyrazol-2-yl]-thiophen-2-yl-methanone Openeye Name: [3-(2-chloro-6-ethoxy-3-quinolyl)-5-(p-tolyl)-1,3-dihydropyrazol-2-yl]-(2-thienyl)methanone CAS Name: [3-(2-chloro-6-ethoxy-3-quinolinyl)-5-(4-methylphenyl)-1,3-dihydropyrazol-2-yl]-thiophen-2-ylmethanone IUPAC Name: [3-(2-chloro-6-ethoxyquinolin-3-yl)-5-(4-methylphenyl)-1,3-dihydropyrazol-2-yl]-thiophen-2-ylmethanone Traditional Name: [5-(2-chloro-6-ethoxy-3-quinolyl)-3-(p-tolyl)-3-pyrazolin-1-yl]-(2-thienyl)methanone Formula: C26H22ClN3O2S MolecularWeight: 475.98978

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=CC(=C(N=C2C=C1)Cl)C3C=C(NN3C(=O)C4=CC=CS4)C5=CC=C(C=C5)C

Isomeric SMILES

CCOC1=CC2=CC(=C(N=C2C=C1)Cl)C3C=C(NN3C(=O)C4=CC=CS4)C5=CC=C(C=C5)C

InChI

InChI=1S/C26H22ClN3O2S/c1-3-32-19-10-11-21-18(13-19)14-20(25(27)28-21)23-15-22(17-8-6-16(2)7-9-17)29-30(23)26(31)24-5-4-12-33-24/h4-15,23,29H,3H2,1-2H3