[2-[(2-azanyl-2-sulfanylidene-ethanethioyl)amino]-1-octanoyloxy-ethyl] octanoate

Systemtic Name: [2-[(2-azanyl-2-sulfanylidene-ethanethioyl)amino]-1-octanoyloxy-ethyl] octanoate Openeye Name: [2-[(2-amino-2-thioxo-ethanethioyl)amino]-1-octanoyloxy-ethyl] octanoate CAS Name: octanoic acid [2-[[2-amino-1,2-bis(sulfanylidene)ethyl]amino]-1-(1-oxooctoxy)ethyl] ester IUPAC Name: [2-[(2-amino-2-sulfanylideneethanethioyl)amino]-1-octanoyloxyethyl] octanoate Traditional Name: caprylic acid [2-[(2-amino-2-thioxo-thioacetyl)amino]-1-caprylyloxy-ethyl] ester Formula: C20H36N2O4S2 MolecularWeight: 432.64084

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OC(CNC(=S)C(=S)N)OC(=O)CCCCCCC

Isomeric SMILES

CCCCCCCC(=O)OC(CNC(=S)C(=S)N)OC(=O)CCCCCCC

InChI

InChI=1S/C20H36N2O4S2/c1-3-5-7-9-11-13-16(23)25-18(15-22-20(28)19(21)27)26-17(24)14-12-10-8-6-4-2/h18H,3-15H2,1-2H3,(H2,21,27)(H,22,28)