1-ethanoyl-N-[(1-phenylpyrazol-4-yl)methyl]-3,4-dihydro-2H-quinoline-6-sulfonamide

Systemtic Name: 1-ethanoyl-N-[(1-phenylpyrazol-4-yl)methyl]-3,4-dihydro-2H-quinoline-6-sulfonamide Openeye Name: 1-acetyl-N-[(1-phenylpyrazol-4-yl)methyl]-3,4-dihydro-2H-quinoline-6-sulfonamide CAS Name: 1-acetyl-N-[(1-phenyl-4-pyrazolyl)methyl]-3,4-dihydro-2H-quinoline-6-sulfonamide IUPAC Name: 1-acetyl-N-[(1-phenylpyrazol-4-yl)methyl]-3,4-dihydro-2H-quinoline-6-sulfonamide Traditional Name: 1-acetyl-N-[(1-phenylpyrazol-4-yl)methyl]-3,4-dihydro-2H-quinoline-6-sulfonamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCC2=C1C=CC(=C2)S(=O)(=O)NCC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)N1CCCC2=C1C=CC(=C2)S(=O)(=O)NCC3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H22N4O3S/c1-16(26)24-11-5-6-18-12-20(9-10-21(18)24)29(27,28)23-14-17-13-22-25(15-17)19-7-3-2-4-8-19/h2-4,7-10,12-13,15,23H,5-6,11,14H2,1H3