2-ethylsulfonyl-N-[2-[(4-methoxyphenyl)sulfonylamino]ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-ethylsulfonyl-N-[2-[(4-methoxyphenyl)sulfonylamino]ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-ethylsulfonyl-N-[2-[(4-methoxyphenyl)sulfonylamino]ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-ethylsulfonyl-N-[2-[(4-methoxyphenyl)sulfonylamino]ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-ethylsulfonyl-N-[2-[(4-methoxyphenyl)sulfonylamino]ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-esyl-N-[2-[(4-methoxyphenyl)sulfonylamino]ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C21H27N3O6S2 MolecularWeight: 481.58558

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CC2=CC=CC=C2CC1C(=O)NCCNS(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CCS(=O)(=O)N1CC2=CC=CC=C2CC1C(=O)NCCNS(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H27N3O6S2/c1-3-31(26,27)24-15-17-7-5-4-6-16(17)14-20(24)21(25)22-12-13-23-32(28,29)19-10-8-18(30-2)9-11-19/h4-11,20,23H,3,12-15H2,1-2H3,(H,22,25)