2-[2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-[2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-[2-(4-indan-5-ylsulfonylpiperazin-1-yl)-2-oxo-ethyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-[2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1-piperazinyl]-2-oxoethyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-[2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-2-oxoethyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-[2-(4-indan-5-ylsulfonylpiperazino)-2-keto-ethyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C26H32N4O4S MolecularWeight: 496.62168

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CC2=CC=CC=C2CN1CC(=O)N3CCN(CC3)S(=O)(=O)C4=CC5=C(CCC5)C=C4

Isomeric SMILES

CNC(=O)C1CC2=CC=CC=C2CN1CC(=O)N3CCN(CC3)S(=O)(=O)C4=CC5=C(CCC5)C=C4

InChI

InChI=1S/C26H32N4O4S/c1-27-26(32)24-16-21-5-2-3-6-22(21)17-29(24)18-25(31)28-11-13-30(14-12-28)35(33,34)23-10-9-19-7-4-8-20(19)15-23/h2-3,5-6,9-10,15,24H,4,7-8,11-14,16-18H2,1H3,(H,27,32)