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

Systemtic Name: S-[(E)-3-(octylamino)-3-oxidanylidene-prop-1-enyl] furan-3-carbothioate Openeye Name: S-[(E)-3-(octylamino)-3-oxo-prop-1-enyl] furan-3-carbothioate CAS Name: 3-furancarbothioic acid S-[(E)-3-(octylamino)-3-oxoprop-1-enyl] ester IUPAC Name: S-[(E)-3-(octylamino)-3-oxoprop-1-enyl] furan-3-carbothioate Traditional Name: furan-3-carbothioic acid S-[(E)-3-keto-3-(octylamino)prop-1-enyl] ester Formula: C16H23NO3S MolecularWeight: 309.42372

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)C=CSC(=O)C1=COC=C1

Isomeric SMILES

CCCCCCCCNC(=O)/C=C/SC(=O)C1=COC=C1

InChI

InChI=1S/C16H23NO3S/c1-2-3-4-5-6-7-10-17-15(18)9-12-21-16(19)14-8-11-20-13-14/h8-9,11-13H,2-7,10H2,1H3,(H,17,18)/b12-9+