[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-(1-ethyl-5-methyl-pyrazol-4-yl)sulfonyl-azanide

Systemtic Name: [4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-(1-ethyl-5-methyl-pyrazol-4-yl)sulfonyl-azanide Openeye Name: [4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-(1-ethyl-5-methyl-pyrazol-4-yl)sulfonyl-azanide CAS Name: [4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-[(1-ethyl-5-methyl-4-pyrazolyl)sulfonyl]azanide IUPAC Name: [4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-(1-ethyl-5-methylpyrazol-4-yl)sulfonylazanide Traditional Name: [4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]-(1-ethyl-5-methyl-pyrazol-4-yl)sulfonyl-azanide Formula: C21H23N4O4S2- MolecularWeight: 459.56172

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)S(=O)(=O)[N-]C2=CC=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)C

Isomeric SMILES

CCN1C(=C(C=N1)S(=O)(=O)[N-]C2=CC=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)C

InChI

InChI=1S/C21H23N4O4S2/c1-3-25-16(2)21(14-22-25)30(26,27)23-19-8-10-20(11-9-19)31(28,29)24-13-12-17-6-4-5-7-18(17)15-24/h4-11,14H,3,12-13,15H2,1-2H3/q-1