2-[2-[(7-methoxy-1-methoxycarbonyl-4,5-dihydrobenzo[e][1]benzothiol-2-yl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: 2-[2-[(7-methoxy-1-methoxycarbonyl-4,5-dihydrobenzo[e][1]benzothiol-2-yl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: 2-[2-[(7-methoxy-1-methoxycarbonyl-4,5-dihydrobenzo[e]benzothiophen-2-yl)amino]-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-[(7-methoxy-1-methoxycarbonyl-4,5-dihydrobenzo[e][1]benzothiol-2-yl)amino]-2-oxoethyl]thio]acetate IUPAC Name: 2-[2-[(7-methoxy-1-methoxycarbonyl-4,5-dihydrobenzo[e][1]benzothiol-2-yl)amino]-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-[(1-carbomethoxy-7-methoxy-4,5-dihydrobenzo[e]benzothiophen-2-yl)amino]-2-keto-ethyl]thio]acetate Formula: C19H18NO6S2- MolecularWeight: 420.47932

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C3=C(CC2)SC(=C3C(=O)OC)NC(=O)CSCC(=O)[O-]

Isomeric SMILES

COC1=CC2=C(C=C1)C3=C(CC2)SC(=C3C(=O)OC)NC(=O)CSCC(=O)[O-]

InChI

InChI=1S/C19H19NO6S2/c1-25-11-4-5-12-10(7-11)3-6-13-16(12)17(19(24)26-2)18(28-13)20-14(21)8-27-9-15(22)23/h4-5,7H,3,6,8-9H2,1-2H3,(H,20,21)(H,22,23)/p-1