3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]benzamide

Systemtic Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]benzamide Openeye Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]benzamide CAS Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-methyl-N-[(1-phenyl-4-pyrazolyl)methyl]benzamide IUPAC Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]benzamide Traditional Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]benzamide Formula: C27H26N4O3S MolecularWeight: 486.58534

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)C2=CC=CC=C2)C(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCC5=CC=CC=C5C4

Isomeric SMILES

CN(CC1=CN(N=C1)C2=CC=CC=C2)C(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C27H26N4O3S/c1-29(18-21-17-28-31(19-21)25-11-3-2-4-12-25)27(32)23-10-7-13-26(16-23)35(33,34)30-15-14-22-8-5-6-9-24(22)20-30/h2-13,16-17,19H,14-15,18,20H2,1H3