ethyl 5-(2-ethylsulfanylpyridin-3-yl)carbonyloxy-2-methyl-1-phenyl-indole-3-carboxylate

Systemtic Name: ethyl 5-(2-ethylsulfanylpyridin-3-yl)carbonyloxy-2-methyl-1-phenyl-indole-3-carboxylate Openeye Name: ethyl 5-(2-ethylsulfanylpyridine-3-carbonyl)oxy-2-methyl-1-phenyl-indole-3-carboxylate CAS Name: 5-[[2-(ethylthio)-3-pyridinyl]-oxomethoxy]-2-methyl-1-phenyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(2-ethylsulfanylpyridine-3-carbonyl)oxy-2-methyl-1-phenylindole-3-carboxylate Traditional Name: 5-[2-(ethylthio)nicotinoyl]oxy-2-methyl-1-phenyl-indole-3-carboxylic acid ethyl ester Formula: C26H24N2O4S MolecularWeight: 460.54476

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OC(=O)C3=C(N=CC=C3)SCC)C4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OC(=O)C3=C(N=CC=C3)SCC)C4=CC=CC=C4)C

InChI

InChI=1S/C26H24N2O4S/c1-4-31-26(30)23-17(3)28(18-10-7-6-8-11-18)22-14-13-19(16-21(22)23)32-25(29)20-12-9-15-27-24(20)33-5-2/h6-16H,4-5H2,1-3H3