2-azanylidene-N-[3-(methoxymethyl)-7-borabicyclo[3.3.1]non-3-en-7-yl]-N-phenyl-pyridine-1-carbothioamide

Systemtic Name: 2-azanylidene-N-[3-(methoxymethyl)-7-borabicyclo[3.3.1]non-3-en-7-yl]-N-phenyl-pyridine-1-carbothioamide Openeye Name: 2-imino-N-[3-(methoxymethyl)-7-borabicyclo[3.3.1]non-3-en-7-yl]-N-phenyl-pyridine-1-carbothioamide CAS Name: 2-imino-N-[3-(methoxymethyl)-7-borabicyclo[3.3.1]non-3-en-7-yl]-N-phenyl-1-pyridinecarbothioamide IUPAC Name: 2-imino-N-[3-(methoxymethyl)-7-borabicyclo[3.3.1]non-3-en-7-yl]-N-phenylpyridine-1-carbothioamide Traditional Name: 2-imino-N-[3-(methoxymethyl)-7-borabicyclo[3.3.1]non-3-en-7-yl]-N-phenyl-pyridine-1-carbothioamide Formula: C22H26BN3OS MolecularWeight: 391.33734

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Descriptors Computed from Structure

Canonical SMILES:

B1(CC2CC(C1)C=C(C2)COC)N(C3=CC=CC=C3)C(=S)N4C=CC=CC4=N

Isomeric SMILES

B1(CC2CC(C1)C=C(C2)COC)N(C3=CC=CC=C3)C(=S)N4C=CC=CC4=N

InChI

InChI=1S/C22H26BN3OS/c1-27-16-19-12-17-11-18(13-19)15-23(14-17)26(20-7-3-2-4-8-20)22(28)25-10-6-5-9-21(25)24/h2-10,12,17-18,24H,11,13-16H2,1H3