2-(3-tert-butyl-1-methyl-pyrazol-4-yl)sulfonyl-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-(3-tert-butyl-1-methyl-pyrazol-4-yl)sulfonyl-3,4-dihydro-1H-isoquinoline Openeye Name: 2-(3-tert-butyl-1-methyl-pyrazol-4-yl)sulfonyl-3,4-dihydro-1H-isoquinoline CAS Name: 2-[(3-tert-butyl-1-methyl-4-pyrazolyl)sulfonyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-(3-tert-butyl-1-methylpyrazol-4-yl)sulfonyl-3,4-dihydro-1H-isoquinoline Traditional Name: 2-(3-tert-butyl-1-methyl-pyrazol-4-yl)sulfonyl-3,4-dihydro-1H-isoquinoline Formula: C17H23N3O2S MolecularWeight: 333.44842

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C=C1S(=O)(=O)N2CCC3=CC=CC=C3C2)C

Isomeric SMILES

CC(C)(C)C1=NN(C=C1S(=O)(=O)N2CCC3=CC=CC=C3C2)C

InChI

InChI=1S/C17H23N3O2S/c1-17(2,3)16-15(12-19(4)18-16)23(21,22)20-10-9-13-7-5-6-8-14(13)11-20/h5-8,12H,9-11H2,1-4H3