1-[3-tert-butyl-1-(phenylmethyl)pyrazol-4-yl]sulfonyl-3,4-dihydro-2H-quinoline

Systemtic Name: 1-[3-tert-butyl-1-(phenylmethyl)pyrazol-4-yl]sulfonyl-3,4-dihydro-2H-quinoline Openeye Name: 1-(1-benzyl-3-tert-butyl-pyrazol-4-yl)sulfonyl-3,4-dihydro-2H-quinoline CAS Name: 1-[[3-tert-butyl-1-(phenylmethyl)-4-pyrazolyl]sulfonyl]-3,4-dihydro-2H-quinoline IUPAC Name: 1-(1-benzyl-3-tert-butylpyrazol-4-yl)sulfonyl-3,4-dihydro-2H-quinoline Traditional Name: 1-(1-benzyl-3-tert-butyl-pyrazol-4-yl)sulfonyl-3,4-dihydro-2H-quinoline Formula: C23H27N3O2S MolecularWeight: 409.54438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C=C1S(=O)(=O)N2CCCC3=CC=CC=C32)CC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=NN(C=C1S(=O)(=O)N2CCCC3=CC=CC=C32)CC4=CC=CC=C4

InChI

InChI=1S/C23H27N3O2S/c1-23(2,3)22-21(17-25(24-22)16-18-10-5-4-6-11-18)29(27,28)26-15-9-13-19-12-7-8-14-20(19)26/h4-8,10-12,14,17H,9,13,15-16H2,1-3H3