[(5Z)-5-[(1-dithiophen-2-ylboranyl-3,5-dimethyl-pyrrol-2-yl)methylidene]-4-methoxy-pyrrol-2-yl] ethanoate

Systemtic Name: [(5Z)-5-[(1-dithiophen-2-ylboranyl-3,5-dimethyl-pyrrol-2-yl)methylidene]-4-methoxy-pyrrol-2-yl] ethanoate Openeye Name: [(5Z)-5-[[1-[bis(2-thienyl)boranyl]-3,5-dimethyl-pyrrol-2-yl]methylene]-4-methoxy-pyrrol-2-yl] acetate CAS Name: acetic acid [(5Z)-5-[(1-dithiophen-2-ylboranyl-3,5-dimethyl-2-pyrrolyl)methylidene]-4-methoxy-2-pyrrolyl] ester IUPAC Name: [(5Z)-5-[(1-dithiophen-2-ylboranyl-3,5-dimethylpyrrol-2-yl)methylidene]-4-methoxypyrrol-2-yl] acetate Traditional Name: acetic acid [(5Z)-5-[[1-[bis(2-thienyl)boranyl]-3,5-dimethyl-pyrrol-2-yl]methylene]-4-methoxy-pyrrol-2-yl] ester Formula: C22H21BN2O3S2 MolecularWeight: 436.35474

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC=CS1)(C2=CC=CS2)N3C(=CC(=C3C=C4C(=CC(=N4)OC(=O)C)OC)C)C

Isomeric SMILES

B(C1=CC=CS1)(C2=CC=CS2)N3C(=CC(=C3/C=C\4/C(=CC(=N4)OC(=O)C)OC)C)C

InChI

InChI=1S/C22H21BN2O3S2/c1-14-11-15(2)25(23(20-7-5-9-29-20)21-8-6-10-30-21)18(14)12-17-19(27-4)13-22(24-17)28-16(3)26/h5-13H,1-4H3/b17-12-