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

Systemtic Name: S-[(E)-3-(octylamino)-3-oxidanylidene-prop-1-enyl] 4-ethenylbenzenecarbothioate Openeye Name: S-[(E)-3-(octylamino)-3-oxo-prop-1-enyl] 4-vinylbenzenecarbothioate CAS Name: 4-ethenylbenzenecarbothioic acid S-[(E)-3-(octylamino)-3-oxoprop-1-enyl] ester IUPAC Name: S-[(E)-3-(octylamino)-3-oxoprop-1-enyl] 4-ethenylbenzenecarbothioate Traditional Name: 4-vinylthiobenzoic acid S-[(E)-3-keto-3-(octylamino)prop-1-enyl] ester Formula: C20H27NO2S MolecularWeight: 345.49888

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27NO2S/c1-3-5-6-7-8-9-15-21-19(22)14-16-24-20(23)18-12-10-17(4-2)11-13-18/h4,10-14,16H,2-3,5-9,15H2,1H3,(H,21,22)/b16-14+