S-[(E)-3-(octylamino)-3-oxidanylidene-prop-1-enyl] 4-fluoranylbenzenecarbothioate

Systemtic Name: S-[(E)-3-(octylamino)-3-oxidanylidene-prop-1-enyl] 4-fluoranylbenzenecarbothioate Openeye Name: S-[(E)-3-(octylamino)-3-oxo-prop-1-enyl] 4-fluorobenzenecarbothioate CAS Name: 4-fluorobenzenecarbothioic acid S-[(E)-3-(octylamino)-3-oxoprop-1-enyl] ester IUPAC Name: S-[(E)-3-(octylamino)-3-oxoprop-1-enyl] 4-fluorobenzenecarbothioate Traditional Name: 4-fluorothiobenzoic acid S-[(E)-3-keto-3-(octylamino)prop-1-enyl] ester Formula: C18H24FNO2S MolecularWeight: 337.452063

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)C=CSC(=O)C1=CC=C(C=C1)F

Isomeric SMILES

CCCCCCCCNC(=O)/C=C/SC(=O)C1=CC=C(C=C1)F

InChI

InChI=1S/C18H24FNO2S/c1-2-3-4-5-6-7-13-20-17(21)12-14-23-18(22)15-8-10-16(19)11-9-15/h8-12,14H,2-7,13H2,1H3,(H,20,21)/b14-12+