methyl 10-ethoxycarbothioylsulfanyl-13-oxidanylidene-13-phenyl-tridecanoate

Systemtic Name: methyl 10-ethoxycarbothioylsulfanyl-13-oxidanylidene-13-phenyl-tridecanoate Openeye Name: methyl 10-ethoxycarbothioylsulfanyl-13-oxo-13-phenyl-tridecanoate CAS Name: 10-[[ethoxy(sulfanylidene)methyl]thio]-13-oxo-13-phenyltridecanoic acid methyl ester IUPAC Name: methyl 10-ethoxycarbothioylsulfanyl-13-oxo-13-phenyltridecanoate Traditional Name: 10-(ethoxycarbothioylthio)-13-keto-13-phenyl-tridecanoic acid methyl ester Formula: C23H34O4S2 MolecularWeight: 438.64366

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=S)SC(CCCCCCCCC(=O)OC)CCC(=O)C1=CC=CC=C1

Isomeric SMILES

CCOC(=S)SC(CCCCCCCCC(=O)OC)CCC(=O)C1=CC=CC=C1

InChI

InChI=1S/C23H34O4S2/c1-3-27-23(28)29-20(17-18-21(24)19-13-9-8-10-14-19)15-11-6-4-5-7-12-16-22(25)26-2/h8-10,13-14,20H,3-7,11-12,15-18H2,1-2H3