5-[4-(1H-benzimidazol-2-yl)-1,4-diazepan-1-yl]-2-phenyl-2-propan-2-yl-pentanenitrile

Systemtic Name: 5-[4-(1H-benzimidazol-2-yl)-1,4-diazepan-1-yl]-2-phenyl-2-propan-2-yl-pentanenitrile Openeye Name: 5-[4-(1H-benzimidazol-2-yl)-1,4-diazepan-1-yl]-2-isopropyl-2-phenyl-pentanenitrile CAS Name: 5-[4-(1H-benzimidazol-2-yl)-1,4-diazepan-1-yl]-2-phenyl-2-propan-2-ylpentanenitrile IUPAC Name: 5-[4-(1H-benzimidazol-2-yl)-1,4-diazepan-1-yl]-2-phenyl-2-propan-2-ylpentanenitrile Traditional Name: 5-[4-(1H-benzimidazol-2-yl)-1,4-diazepan-1-yl]-2-isopropyl-2-phenyl-valeronitrile Formula: C26H33N5 MolecularWeight: 415.57372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCN1CCCN(CC1)C2=NC3=CC=CC=C3N2)(C#N)C4=CC=CC=C4

Isomeric SMILES

CC(C)C(CCCN1CCCN(CC1)C2=NC3=CC=CC=C3N2)(C#N)C4=CC=CC=C4

InChI

InChI=1S/C26H33N5/c1-21(2)26(20-27,22-10-4-3-5-11-22)14-8-15-30-16-9-17-31(19-18-30)25-28-23-12-6-7-13-24(23)29-25/h3-7,10-13,21H,8-9,14-19H2,1-2H3,(H,28,29)