methyl (1R,2S)-1-imidazol-1-ylcarbothioyloxy-4,7-dimethoxy-2,5-dimethyl-6-(2-phenylmethoxyethyl)-1,3-dihydroindene-2-carboxylate

Systemtic Name: methyl (1R,2S)-1-imidazol-1-ylcarbothioyloxy-4,7-dimethoxy-2,5-dimethyl-6-(2-phenylmethoxyethyl)-1,3-dihydroindene-2-carboxylate Openeye Name: methyl (1R,2S)-6-(2-benzyloxyethyl)-1-(imidazole-1-carbothioyloxy)-4,7-dimethoxy-2,5-dimethyl-indane-2-carboxylate CAS Name: (1R,2S)-1-[1-imidazolyl(sulfanylidene)methoxy]-4,7-dimethoxy-2,5-dimethyl-6-(2-phenylmethoxyethyl)-1,3-dihydroindene-2-carboxylic acid methyl ester IUPAC Name: methyl (1R,2S)-1-(imidazole-1-carbothioyloxy)-4,7-dimethoxy-2,5-dimethyl-6-(2-phenylmethoxyethyl)-1,3-dihydroindene-2-carboxylate Traditional Name: (1R,2S)-6-(2-benzoxyethyl)-1-(imidazole-1-carbothioyloxy)-4,7-dimethoxy-2,5-dimethyl-indane-2-carboxylic acid methyl ester Formula: C28H32N2O6S MolecularWeight: 524.62848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C(C(C2)(C)C(=O)OC)OC(=S)N3C=CN=C3)C(=C1CCOCC4=CC=CC=C4)OC)OC

Isomeric SMILES

CC1=C(C2=C([C@H]([C@@](C2)(C)C(=O)OC)OC(=S)N3C=CN=C3)C(=C1CCOCC4=CC=CC=C4)OC)OC

InChI

InChI=1S/C28H32N2O6S/c1-18-20(11-14-35-16-19-9-7-6-8-10-19)24(33-4)22-21(23(18)32-3)15-28(2,26(31)34-5)25(22)36-27(37)30-13-12-29-17-30/h6-10,12-13,17,25H,11,14-16H2,1-5H3/t25-,28+/m1/s1