1-cyano-2-[2-[[6-(dimethylaminomethyl)-1-benzofuran-2-yl]methylsulfanyl]ethyl]guanidine

Systemtic Name: 1-cyano-2-[2-[[6-(dimethylaminomethyl)-1-benzofuran-2-yl]methylsulfanyl]ethyl]guanidine Openeye Name: 1-cyano-2-[2-[[6-(dimethylaminomethyl)benzofuran-2-yl]methylsulfanyl]ethyl]guanidine CAS Name: 1-cyano-2-[2-[[6-(dimethylaminomethyl)-2-benzofuranyl]methylthio]ethyl]guanidine IUPAC Name: 1-cyano-2-[2-[[6-(dimethylaminomethyl)-1-benzofuran-2-yl]methylsulfanyl]ethyl]guanidine Traditional Name: 1-cyano-2-[2-[[6-(dimethylaminomethyl)benzofuran-2-yl]methylthio]ethyl]guanidine Formula: C16H21N5OS MolecularWeight: 331.43584

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC2=C(C=C1)C=C(O2)CSCCN=C(N)NC#N

Isomeric SMILES

CN(C)CC1=CC2=C(C=C1)C=C(O2)CSCCN=C(N)NC#N

InChI

InChI=1S/C16H21N5OS/c1-21(2)9-12-3-4-13-8-14(22-15(13)7-12)10-23-6-5-19-16(18)20-11-17/h3-4,7-8H,5-6,9-10H2,1-2H3,(H3,18,19,20)