2-dimethylaminoethyl 4-[(5Z)-5-[(4-bromophenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate

Systemtic Name: 2-dimethylaminoethyl 4-[(5Z)-5-[(4-bromophenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate Openeye Name: 2-dimethylaminoethyl 4-[(5Z)-5-[(4-bromophenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]butanoate CAS Name: 4-[(5Z)-5-[(4-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]butanoic acid 2-dimethylaminoethyl ester IUPAC Name: 2-dimethylaminoethyl 4-[(5Z)-5-[(4-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate Traditional Name: 4-[(5Z)-5-(4-bromobenzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]butyric acid 2-dimethylaminoethyl ester Formula: C18H21BrN2O3S2 MolecularWeight: 457.40494

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCOC(=O)CCCN1C(=O)C(=CC2=CC=C(C=C2)Br)SC1=S

Isomeric SMILES

CN(C)CCOC(=O)CCCN1C(=O)/C(=C/C2=CC=C(C=C2)Br)/SC1=S

InChI

InChI=1S/C18H21BrN2O3S2/c1-20(2)10-11-24-16(22)4-3-9-21-17(23)15(26-18(21)25)12-13-5-7-14(19)8-6-13/h5-8,12H,3-4,9-11H2,1-2H3/b15-12-