4-(5-butyl-1,3,2-dithiaborinan-2-yl)benzenecarbonitrile

Systemtic Name: 4-(5-butyl-1,3,2-dithiaborinan-2-yl)benzenecarbonitrile Openeye Name: 4-(5-butyl-1,3,2-dithiaborinan-2-yl)benzonitrile CAS Name: 4-(5-butyl-1,3,2-dithiaborinan-2-yl)benzonitrile IUPAC Name: 4-(5-butyl-1,3,2-dithiaborinan-2-yl)benzonitrile Traditional Name: 4-(5-butyl-1,3,2-dithiaborinan-2-yl)benzonitrile Formula: C14H18BNS2 MolecularWeight: 275.24042

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Descriptors Computed from Structure

Canonical SMILES:

B1(SCC(CS1)CCCC)C2=CC=C(C=C2)C#N

Isomeric SMILES

B1(SCC(CS1)CCCC)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C14H18BNS2/c1-2-3-4-13-10-17-15(18-11-13)14-7-5-12(9-16)6-8-14/h5-8,13H,2-4,10-11H2,1H3