O-[1-(5-ethyltridecanethioyloxy)butyl] 5-ethyltridecanethioate; methane; O-methyl 5-ethyltridecanethioate

Systemtic Name: O-[1-(5-ethyltridecanethioyloxy)butyl] 5-ethyltridecanethioate; methane; O-methyl 5-ethyltridecanethioate Openeye Name: O-[1-(5-ethyltridecanethioyloxy)butyl] 5-ethyltridecanethioate; methane; O-methyl 5-ethyltridecanethioate CAS Name: 5-ethyltridecanethioic acid O-[1-(5-ethyl-1-sulfanylidenetridecoxy)butyl] ester; 5-ethyltridecanethioic acid O-methyl ester; methane IUPAC Name: O-[1-(5-ethyltridecanethioyloxy)butyl] 5-ethyltridecanethioate; methane; O-methyl 5-ethyltridecanethioate Traditional Name: 5-ethyltridecanethioic acid O-[1-(5-ethyltridecanethioyloxy)butyl] ester; 5-ethyltridecanethioic acid O-methyl ester; methane Formula: C51H102O3S3 MolecularWeight: 859.54878

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Descriptors Computed from Structure

Canonical SMILES:

C.CCCCCCCCC(CC)CCCC(=S)OC.CCCCCCCCC(CC)CCCC(=S)OC(CCC)OC(=S)CCCC(CC)CCCCCCCC

Isomeric SMILES

C.CCCCCCCCC(CC)CCCC(=S)OC.CCCCCCCCC(CC)CCCC(=S)OC(CCC)OC(=S)CCCC(CC)CCCCCCCC

InChI

InChI=1S/C34H66O2S2.C16H32OS.CH4/c1-6-11-13-15-17-19-24-30(9-4)26-21-28-33(37)35-32(23-8-3)36-34(38)29-22-27-31(10-5)25-20-18-16-14-12-7-2;1-4-6-7-8-9-10-12-15(5-2)13-11-14-16(18)17-3;/h30-32H,6-29H2,1-5H3;15H,4-14H2,1-3H3;1H4