methyl 2-phenyl-3-thiophen-2-yl-1H-thieno[2,3-e][1,2]azaborinine-6-carboxylate

Systemtic Name: methyl 2-phenyl-3-thiophen-2-yl-1H-thieno[2,3-e][1,2]azaborinine-6-carboxylate Openeye Name: methyl 2-phenyl-3-(2-thienyl)-1H-thieno[2,3-e]azaborinine-6-carboxylate CAS Name: 2-phenyl-3-thiophen-2-yl-1H-thieno[2,3-e]azaborine-6-carboxylic acid methyl ester IUPAC Name: methyl 2-phenyl-3-thiophen-2-yl-1H-thieno[2,3-e]azaborinine-6-carboxylate Traditional Name: 2-phenyl-3-(2-thienyl)-1H-thien[2,3-e]azaborine-6-carboxylic acid methyl ester Formula: C18H14BNO2S2 MolecularWeight: 351.25026

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Descriptors Computed from Structure

Canonical SMILES:

B1(C(=CC2=C(N1)C=C(S2)C(=O)OC)C3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

B1(C(=CC2=C(N1)C=C(S2)C(=O)OC)C3=CC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C18H14BNO2S2/c1-22-18(21)17-11-14-16(24-17)10-13(15-8-5-9-23-15)19(20-14)12-6-3-2-4-7-12/h2-11,20H,1H3