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

Systemtic Name: pentyl 3-[(5Z)-5-[(3-bromophenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoate Openeye Name: pentyl 3-[(5Z)-5-[(3-bromophenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]propanoate CAS Name: 3-[(5Z)-5-[(3-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]propanoic acid pentyl ester IUPAC Name: pentyl 3-[(5Z)-5-[(3-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoate Traditional Name: 3-[(5Z)-5-(3-bromobenzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]propionic acid amyl ester Formula: C18H20BrNO3S2 MolecularWeight: 442.3903

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)CCN1C(=O)C(=CC2=CC(=CC=C2)Br)SC1=S

Isomeric SMILES

CCCCCOC(=O)CCN1C(=O)/C(=C/C2=CC(=CC=C2)Br)/SC1=S

InChI

InChI=1S/C18H20BrNO3S2/c1-2-3-4-10-23-16(21)8-9-20-17(22)15(25-18(20)24)12-13-6-5-7-14(19)11-13/h5-7,11-12H,2-4,8-10H2,1H3/b15-12-