methyl 2-[4-(4-bromophenyl)-2-sulfanylidene-1H-imidazol-3-yl]ethanoate

Systemtic Name: methyl 2-[4-(4-bromophenyl)-2-sulfanylidene-1H-imidazol-3-yl]ethanoate Openeye Name: methyl 2-[4-(4-bromophenyl)-2-thioxo-1H-imidazol-3-yl]acetate CAS Name: 2-[4-(4-bromophenyl)-2-sulfanylidene-1H-imidazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[4-(4-bromophenyl)-2-sulfanylidene-1H-imidazol-3-yl]acetate Traditional Name: 2-[5-(4-bromophenyl)-2-thioxo-4-imidazolin-1-yl]acetic acid methyl ester Formula: C12H11BrN2O2S MolecularWeight: 327.19694

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C(=CNC1=S)C2=CC=C(C=C2)Br

Isomeric SMILES

COC(=O)CN1C(=CNC1=S)C2=CC=C(C=C2)Br

InChI

InChI=1S/C12H11BrN2O2S/c1-17-11(16)7-15-10(6-14-12(15)18)8-2-4-9(13)5-3-8/h2-6H,7H2,1H3,(H,14,18)