1-cyano-3-[2-[[2-(dimethylaminomethyl)-3H-benzimidazol-5-yl]methylsulfanyl]ethyl]-2-methyl-guanidine

Systemtic Name: 1-cyano-3-[2-[[2-(dimethylaminomethyl)-3H-benzimidazol-5-yl]methylsulfanyl]ethyl]-2-methyl-guanidine Openeye Name: 1-cyano-3-[2-[[2-(dimethylaminomethyl)-3H-benzimidazol-5-yl]methylsulfanyl]ethyl]-2-methyl-guanidine CAS Name: 1-cyano-3-[2-[[2-(dimethylaminomethyl)-3H-benzimidazol-5-yl]methylthio]ethyl]-2-methylguanidine IUPAC Name: 1-cyano-3-[2-[[2-(dimethylaminomethyl)-3H-benzimidazol-5-yl]methylsulfanyl]ethyl]-2-methylguanidine Traditional Name: 1-cyano-3-[2-[[2-(dimethylaminomethyl)-3H-benzimidazol-5-yl]methylthio]ethyl]-2-methyl-guanidine Formula: C16H23N7S MolecularWeight: 345.46572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN=C(NCCSCC1=CC2=C(C=C1)N=C(N2)CN(C)C)NC#N

Isomeric SMILES

CN=C(NCCSCC1=CC2=C(C=C1)N=C(N2)CN(C)C)NC#N

InChI

InChI=1S/C16H23N7S/c1-18-16(20-11-17)19-6-7-24-10-12-4-5-13-14(8-12)22-15(21-13)9-23(2)3/h4-5,8H,6-7,9-10H2,1-3H3,(H,21,22)(H2,18,19,20)