[(E)-(1-bromanyl-6,6-dimethyl-3-methylsulfanyl-5,7-dihydro-2-benzothiophen-4-ylidene)amino] ethanoate

Systemtic Name: [(E)-(1-bromanyl-6,6-dimethyl-3-methylsulfanyl-5,7-dihydro-2-benzothiophen-4-ylidene)amino] ethanoate Openeye Name: [(E)-(1-bromo-6,6-dimethyl-3-methylsulfanyl-5,7-dihydro-2-benzothiophen-4-ylidene)amino] acetate CAS Name: acetic acid [(E)-[1-bromo-6,6-dimethyl-3-(methylthio)-5,7-dihydro-2-benzothiophen-4-ylidene]amino] ester IUPAC Name: [(E)-(1-bromo-6,6-dimethyl-3-methylsulfanyl-5,7-dihydro-2-benzothiophen-4-ylidene)amino] acetate Traditional Name: acetic acid [(E)-[1-bromo-6,6-dimethyl-3-(methylthio)-5,7-dihydroisobenzothiophen-4-ylidene]amino] ester Formula: C13H16BrNO2S2 MolecularWeight: 362.30564

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)ON=C1CC(CC2=C(SC(=C21)SC)Br)(C)C

Isomeric SMILES

CC(=O)O/N=C/1\CC(CC2=C(SC(=C21)SC)Br)(C)C

InChI

InChI=1S/C13H16BrNO2S2/c1-7(16)17-15-9-6-13(2,3)5-8-10(9)12(18-4)19-11(8)14/h5-6H2,1-4H3/b15-9+