2-cyclohexyl-1-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-3,5-dimethyl-pyrazol-1-yl]ethanone

Systemtic Name: 2-cyclohexyl-1-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-3,5-dimethyl-pyrazol-1-yl]ethanone Openeye Name: 2-cyclohexyl-1-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-3,5-dimethyl-pyrazol-1-yl]ethanone CAS Name: 2-cyclohexyl-1-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-3,5-dimethyl-1-pyrazolyl]ethanone IUPAC Name: 2-cyclohexyl-1-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-3,5-dimethylpyrazol-1-yl]ethanone Traditional Name: 2-cyclohexyl-1-[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-3,5-dimethyl-pyrazol-1-yl]ethanone Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(=O)CC2CCCCC2)C)S(=O)(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=C(C(=NN1C(=O)CC2CCCCC2)C)S(=O)(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C22H29N3O3S/c1-16-22(17(2)25(23-16)21(26)14-18-8-4-3-5-9-18)29(27,28)24-13-12-19-10-6-7-11-20(19)15-24/h6-7,10-11,18H,3-5,8-9,12-15H2,1-2H3