methyl (Z)-6-pyridin-3-yl-6-[2-(thiophen-2-ylsulfonylamino)-2,3-dihydro-1H-inden-5-yl]hex-5-enoate

Systemtic Name: methyl (Z)-6-pyridin-3-yl-6-[2-(thiophen-2-ylsulfonylamino)-2,3-dihydro-1H-inden-5-yl]hex-5-enoate Openeye Name: methyl (Z)-6-(3-pyridyl)-6-[2-(2-thienylsulfonylamino)indan-5-yl]hex-5-enoate CAS Name: (Z)-6-(3-pyridinyl)-6-[2-(thiophen-2-ylsulfonylamino)-2,3-dihydro-1H-inden-5-yl]-5-hexenoic acid methyl ester IUPAC Name: methyl (Z)-6-pyridin-3-yl-6-[2-(thiophen-2-ylsulfonylamino)-2,3-dihydro-1H-inden-5-yl]hex-5-enoate Traditional Name: (Z)-6-(3-pyridyl)-6-[2-(2-thienylsulfonylamino)indan-5-yl]hex-5-enoic acid methyl ester Formula: C25H26N2O4S2 MolecularWeight: 482.61494

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC=C(C1=CC2=C(CC(C2)NS(=O)(=O)C3=CC=CS3)C=C1)C4=CN=CC=C4

Isomeric SMILES

COC(=O)CCC/C=C(/C1=CC2=C(CC(C2)NS(=O)(=O)C3=CC=CS3)C=C1)\C4=CN=CC=C4

InChI

InChI=1S/C25H26N2O4S2/c1-31-24(28)8-3-2-7-23(20-6-4-12-26-17-20)19-11-10-18-15-22(16-21(18)14-19)27-33(29,30)25-9-5-13-32-25/h4-7,9-14,17,22,27H,2-3,8,15-16H2,1H3/b23-7-