methyl 4-[(5-bromanyl-2,5-dihydrothiophen-2-yl)methylideneamino]benzoate

Systemtic Name: methyl 4-[(5-bromanyl-2,5-dihydrothiophen-2-yl)methylideneamino]benzoate Openeye Name: methyl 4-[(5-bromo-2,5-dihydrothiophen-2-yl)methyleneamino]benzoate CAS Name: 4-[(5-bromo-2,5-dihydrothiophen-2-yl)methylideneamino]benzoic acid methyl ester IUPAC Name: methyl 4-[(5-bromo-2,5-dihydrothiophen-2-yl)methylideneamino]benzoate Traditional Name: 4-[(5-bromo-2,5-dihydrothiophen-2-yl)methyleneamino]benzoic acid methyl ester Formula: C13H12BrNO2S MolecularWeight: 326.20888

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)N=CC2C=CC(S2)Br

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)N=CC2C=CC(S2)Br

InChI

InChI=1S/C13H12BrNO2S/c1-17-13(16)9-2-4-10(5-3-9)15-8-11-6-7-12(14)18-11/h2-8,11-12H,1H3