S-[(E)-3-(octylamino)-3-oxidanylidene-prop-1-enyl] octanethioate

Systemtic Name: S-[(E)-3-(octylamino)-3-oxidanylidene-prop-1-enyl] octanethioate Openeye Name: S-[(E)-3-(octylamino)-3-oxo-prop-1-enyl] octanethioate CAS Name: octanethioic acid S-[(E)-3-(octylamino)-3-oxoprop-1-enyl] ester IUPAC Name: S-[(E)-3-(octylamino)-3-oxoprop-1-enyl] octanethioate Traditional Name: octanethioic acid S-[(E)-3-keto-3-(octylamino)prop-1-enyl] ester Formula: C19H35NO2S MolecularWeight: 341.5517

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)C=CSC(=O)CCCCCCC

Isomeric SMILES

CCCCCCCCNC(=O)/C=C/SC(=O)CCCCCCC

InChI

InChI=1S/C19H35NO2S/c1-3-5-7-9-11-13-16-20-18(21)15-17-23-19(22)14-12-10-8-6-4-2/h15,17H,3-14,16H2,1-2H3,(H,20,21)/b17-15+