[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)thiophen-2-yl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: [3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)thiophen-2-yl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone Openeye Name: [3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-thienyl]-[4-(2-pyridylmethyl)piperazin-1-yl]methanone CAS Name: [3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-thiophenyl]-[4-(2-pyridinylmethyl)-1-piperazinyl]methanone IUPAC Name: [3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)thiophen-2-yl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone Traditional Name: [3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-thienyl]-[4-(2-pyridylmethyl)piperazino]methanone Formula: C24H26N4O3S2 MolecularWeight: 482.61824

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=C(SC=C3)C(=O)N4CCN(CC4)CC5=CC=CC=N5

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=C(SC=C3)C(=O)N4CCN(CC4)CC5=CC=CC=N5

InChI

InChI=1S/C24H26N4O3S2/c29-24(27-14-12-26(13-15-27)18-21-7-3-4-10-25-21)23-22(9-16-32-23)33(30,31)28-11-8-19-5-1-2-6-20(19)17-28/h1-7,9-10,16H,8,11-15,17-18H2