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

Systemtic Name: 3-cyano-1-methyl-1-[2-(phenylmethylsulfanyl)ethyl]urea Openeye Name: 1-(2-benzylsulfanylethyl)-3-cyano-1-methyl-urea CAS Name: 3-cyano-1-methyl-1-[2-(phenylmethylthio)ethyl]urea IUPAC Name: 1-(2-benzylsulfanylethyl)-3-cyano-1-methylurea Traditional Name: 1-[2-(benzylthio)ethyl]-3-cyano-1-methyl-urea Formula: C12H15N3OS MolecularWeight: 249.332

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCSCC1=CC=CC=C1)C(=O)NC#N

Isomeric SMILES

CN(CCSCC1=CC=CC=C1)C(=O)NC#N

InChI

InChI=1S/C12H15N3OS/c1-15(12(16)14-10-13)7-8-17-9-11-5-3-2-4-6-11/h2-6H,7-9H2,1H3,(H,14,16)