1-methylsulfonyl-N-(3-pyrazol-1-ylphenyl)-3,4-dihydro-2H-quinoline-6-carboxamide

Systemtic Name: 1-methylsulfonyl-N-(3-pyrazol-1-ylphenyl)-3,4-dihydro-2H-quinoline-6-carboxamide Openeye Name: 1-methylsulfonyl-N-(3-pyrazol-1-ylphenyl)-3,4-dihydro-2H-quinoline-6-carboxamide CAS Name: 1-methylsulfonyl-N-[3-(1-pyrazolyl)phenyl]-3,4-dihydro-2H-quinoline-6-carboxamide IUPAC Name: 1-methylsulfonyl-N-(3-pyrazol-1-ylphenyl)-3,4-dihydro-2H-quinoline-6-carboxamide Traditional Name: 1-mesyl-N-(3-pyrazol-1-ylphenyl)-3,4-dihydro-2H-quinoline-6-carboxamide Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCC2=C1C=CC(=C2)C(=O)NC3=CC=CC(=C3)N4C=CC=N4

Isomeric SMILES

CS(=O)(=O)N1CCCC2=C1C=CC(=C2)C(=O)NC3=CC=CC(=C3)N4C=CC=N4

InChI

InChI=1S/C20H20N4O3S/c1-28(26,27)24-12-3-5-15-13-16(8-9-19(15)24)20(25)22-17-6-2-7-18(14-17)23-11-4-10-21-23/h2,4,6-11,13-14H,3,5,12H2,1H3,(H,22,25)