4-[[2-(piperidin-1-ylmethyl)-3H-benzimidazol-5-yl]methylsulfanyl]butanenitrile

Systemtic Name: 4-[[2-(piperidin-1-ylmethyl)-3H-benzimidazol-5-yl]methylsulfanyl]butanenitrile Openeye Name: 4-[[2-(1-piperidylmethyl)-3H-benzimidazol-5-yl]methylsulfanyl]butanenitrile CAS Name: 4-[[2-(1-piperidinylmethyl)-3H-benzimidazol-5-yl]methylthio]butanenitrile IUPAC Name: 4-[[2-(piperidin-1-ylmethyl)-3H-benzimidazol-5-yl]methylsulfanyl]butanenitrile Traditional Name: 4-[[2-(piperidinomethyl)-3H-benzimidazol-5-yl]methylthio]butyronitrile Formula: C18H24N4S MolecularWeight: 328.47496

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=NC3=C(N2)C=C(C=C3)CSCCCC#N

Isomeric SMILES

C1CCN(CC1)CC2=NC3=C(N2)C=C(C=C3)CSCCCC#N

InChI

InChI=1S/C18H24N4S/c19-8-2-5-11-23-14-15-6-7-16-17(12-15)21-18(20-16)13-22-9-3-1-4-10-22/h6-7,12H,1-5,9-11,13-14H2,(H,20,21)