1-cyano-2-methyl-3-[2-(phenylmethylsulfanyl)ethyl]guanidine

Systemtic Name: 1-cyano-2-methyl-3-[2-(phenylmethylsulfanyl)ethyl]guanidine Openeye Name: 1-(2-benzylsulfanylethyl)-3-cyano-2-methyl-guanidine CAS Name: 1-cyano-2-methyl-3-[2-(phenylmethylthio)ethyl]guanidine IUPAC Name: 1-(2-benzylsulfanylethyl)-3-cyano-2-methylguanidine Traditional Name: 1-[2-(benzylthio)ethyl]-3-cyano-2-methyl-guanidine Formula: C12H16N4S MolecularWeight: 248.34724

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Descriptors Computed from Structure

Canonical SMILES:

CN=C(NCCSCC1=CC=CC=C1)NC#N

Isomeric SMILES

CN=C(NCCSCC1=CC=CC=C1)NC#N

InChI

InChI=1S/C12H16N4S/c1-14-12(16-10-13)15-7-8-17-9-11-5-3-2-4-6-11/h2-6H,7-9H2,1H3,(H2,14,15,16)