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

Systemtic Name: propan-2-yl N-cyano-N'-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]carbamimidate Openeye Name: 1-cyano-2-isopropyl-3-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]isourea CAS Name: N-cyano-N'-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethyl]carbamimidic acid propan-2-yl ester IUPAC Name: propan-2-yl N-cyano-N'-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]carbamimidate Traditional Name: 1-cyano-2-isopropyl-3-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethyl]isourea Formula: C12H19N5OS MolecularWeight: 281.37716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1)CSCCN=C(NC#N)OC(C)C

Isomeric SMILES

CC1=C(N=CN1)CSCCN=C(NC#N)OC(C)C

InChI

InChI=1S/C12H19N5OS/c1-9(2)18-12(15-7-13)14-4-5-19-6-11-10(3)16-8-17-11/h8-9H,4-6H2,1-3H3,(H,14,15)(H,16,17)