hexadecyl 2-[[5-(2-hexadecoxy-2-oxidanylidene-ethyl)sulfanyl-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate

Systemtic Name: hexadecyl 2-[[5-(2-hexadecoxy-2-oxidanylidene-ethyl)sulfanyl-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate Openeye Name: hexadecyl 2-[[5-(2-hexadecoxy-2-oxo-ethyl)sulfanyl-1,3,4-thiadiazol-2-yl]sulfanyl]acetate CAS Name: 2-[[5-[(2-hexadecoxy-2-oxoethyl)thio]-1,3,4-thiadiazol-2-yl]thio]acetic acid hexadecyl ester IUPAC Name: hexadecyl 2-[[5-(2-hexadecoxy-2-oxoethyl)sulfanyl-1,3,4-thiadiazol-2-yl]sulfanyl]acetate Traditional Name: 2-[[5-[(2-cetyloxy-2-keto-ethyl)thio]-1,3,4-thiadiazol-2-yl]thio]acetic acid cetyl ester Formula: C38H70N2O4S3 MolecularWeight: 715.1684

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=O)CSC1=NN=C(S1)SCC(=O)OCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=O)CSC1=NN=C(S1)SCC(=O)OCCCCCCCCCCCCCCCC

InChI

InChI=1S/C38H70N2O4S3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-43-35(41)33-45-37-39-40-38(47-37)46-34-36(42)44-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-34H2,1-2H3