(2R)-2-(1-methylbenzimidazol-2-yl)-2-(3,4,5,6-tetrahydro-2H-azepin-7-yl)ethanenitrile

Systemtic Name: (2R)-2-(1-methylbenzimidazol-2-yl)-2-(3,4,5,6-tetrahydro-2H-azepin-7-yl)ethanenitrile Openeye Name: (2R)-2-(1-methylbenzimidazol-2-yl)-2-(3,4,5,6-tetrahydro-2H-azepin-7-yl)acetonitrile CAS Name: (2R)-2-(1-methyl-2-benzimidazolyl)-2-(3,4,5,6-tetrahydro-2H-azepin-7-yl)acetonitrile IUPAC Name: (2R)-2-(1-methylbenzimidazol-2-yl)-2-(3,4,5,6-tetrahydro-2H-azepin-7-yl)acetonitrile Traditional Name: (2R)-2-(1-methylbenzimidazol-2-yl)-2-(3,4,5,6-tetrahydro-2H-azepin-7-yl)acetonitrile Formula: C16H18N4 MolecularWeight: 266.34092

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1C(C#N)C3=NCCCCC3

Isomeric SMILES

CN1C2=CC=CC=C2N=C1[C@@H](C#N)C3=NCCCCC3

InChI

InChI=1S/C16H18N4/c1-20-15-9-5-4-8-14(15)19-16(20)12(11-17)13-7-3-2-6-10-18-13/h4-5,8-9,12H,2-3,6-7,10H2,1H3/t12-/m0/s1