[6-(5-chloranyl-1-ethanoyl-2,3-dihydroindol-3-yl)-1-ethoxycarbothioylsulfanyl-4-oxidanylidene-hexyl] 2,2-dimethylpropanoate

Systemtic Name: [6-(5-chloranyl-1-ethanoyl-2,3-dihydroindol-3-yl)-1-ethoxycarbothioylsulfanyl-4-oxidanylidene-hexyl] 2,2-dimethylpropanoate Openeye Name: [6-(1-acetyl-5-chloro-indolin-3-yl)-1-ethoxycarbothioylsulfanyl-4-oxo-hexyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [6-(1-acetyl-5-chloro-2,3-dihydroindol-3-yl)-1-[[ethoxy(sulfanylidene)methyl]thio]-4-oxohexyl] ester IUPAC Name: [6-(1-acetyl-5-chloro-2,3-dihydroindol-3-yl)-1-ethoxycarbothioylsulfanyl-4-oxohexyl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [6-(1-acetyl-5-chloro-indolin-3-yl)-1-(ethoxycarbothioylthio)-4-keto-hexyl] ester Formula: C24H32ClNO5S2 MolecularWeight: 514.09758

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=S)SC(CCC(=O)CCC1CN(C2=C1C=C(C=C2)Cl)C(=O)C)OC(=O)C(C)(C)C

Isomeric SMILES

CCOC(=S)SC(CCC(=O)CCC1CN(C2=C1C=C(C=C2)Cl)C(=O)C)OC(=O)C(C)(C)C

InChI

InChI=1S/C24H32ClNO5S2/c1-6-30-23(32)33-21(31-22(29)24(3,4)5)12-10-18(28)9-7-16-14-26(15(2)27)20-11-8-17(25)13-19(16)20/h8,11,13,16,21H,6-7,9-10,12,14H2,1-5H3