4-[[2-(dimethylaminomethyl)-3H-benzimidazol-5-yl]methylsulfanyl]butanenitrile

Systemtic Name: 4-[[2-(dimethylaminomethyl)-3H-benzimidazol-5-yl]methylsulfanyl]butanenitrile Openeye Name: 4-[[2-(dimethylaminomethyl)-3H-benzimidazol-5-yl]methylsulfanyl]butanenitrile CAS Name: 4-[[2-(dimethylaminomethyl)-3H-benzimidazol-5-yl]methylthio]butanenitrile IUPAC Name: 4-[[2-(dimethylaminomethyl)-3H-benzimidazol-5-yl]methylsulfanyl]butanenitrile Traditional Name: 4-[[2-(dimethylaminomethyl)-3H-benzimidazol-5-yl]methylthio]butyronitrile Formula: C15H20N4S MolecularWeight: 288.4111

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=NC2=C(N1)C=C(C=C2)CSCCCC#N

Isomeric SMILES

CN(C)CC1=NC2=C(N1)C=C(C=C2)CSCCCC#N

InChI

InChI=1S/C15H20N4S/c1-19(2)10-15-17-13-6-5-12(9-14(13)18-15)11-20-8-4-3-7-16/h5-6,9H,3-4,8,10-11H2,1-2H3,(H,17,18)