S-[(E)-3-(octylamino)-3-oxidanylidene-prop-1-enyl] 2,5-bis(chloranyl)thiophene-3-carbothioate

Systemtic Name: S-[(E)-3-(octylamino)-3-oxidanylidene-prop-1-enyl] 2,5-bis(chloranyl)thiophene-3-carbothioate Openeye Name: S-[(E)-3-(octylamino)-3-oxo-prop-1-enyl] 2,5-dichlorothiophene-3-carbothioate CAS Name: 2,5-dichloro-3-thiophenecarbothioic acid S-[(E)-3-(octylamino)-3-oxoprop-1-enyl] ester IUPAC Name: S-[(E)-3-(octylamino)-3-oxoprop-1-enyl] 2,5-dichlorothiophene-3-carbothioate Traditional Name: 2,5-dichlorothiophene-3-carbothioic acid S-[(E)-3-keto-3-(octylamino)prop-1-enyl] ester Formula: C16H21Cl2NO2S2 MolecularWeight: 394.37944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)C=CSC(=O)C1=C(SC(=C1)Cl)Cl

Isomeric SMILES

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

InChI

InChI=1S/C16H21Cl2NO2S2/c1-2-3-4-5-6-7-9-19-14(20)8-10-22-16(21)12-11-13(17)23-15(12)18/h8,10-11H,2-7,9H2,1H3,(H,19,20)/b10-8+