octyl N-cyano-N'-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]carbamimidate

Systemtic Name: octyl N-cyano-N'-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]carbamimidate Openeye Name: 1-cyano-3-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-2-octyl-isourea CAS Name: N-cyano-N'-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethyl]carbamimidic acid octyl ester IUPAC Name: octyl N-cyano-N'-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]carbamimidate Traditional Name: 1-cyano-3-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethyl]-2-octyl-isourea Formula: C17H29N5OS MolecularWeight: 351.51006

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=NCCSCC1=C(NC=N1)C)NC#N

Isomeric SMILES

CCCCCCCCOC(=NCCSCC1=C(NC=N1)C)NC#N

InChI

InChI=1S/C17H29N5OS/c1-3-4-5-6-7-8-10-23-17(20-13-18)19-9-11-24-12-16-15(2)21-14-22-16/h14H,3-12H2,1-2H3,(H,19,20)(H,21,22)