phenyl N-cyano-N'-[4-(1H-imidazol-2-yl)butyl]carbamimidate

Systemtic Name: phenyl N-cyano-N'-[4-(1H-imidazol-2-yl)butyl]carbamimidate Openeye Name: 1-cyano-3-[4-(1H-imidazol-2-yl)butyl]-2-phenyl-isourea CAS Name: N-cyano-N'-[4-(1H-imidazol-2-yl)butyl]carbamimidic acid phenyl ester IUPAC Name: phenyl N-cyano-N'-[4-(1H-imidazol-2-yl)butyl]carbamimidate Traditional Name: 1-cyano-3-[4-(1H-imidazol-2-yl)butyl]-2-phenyl-isourea Formula: C15H17N5O MolecularWeight: 283.32838

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(=NCCCCC2=NC=CN2)NC#N

Isomeric SMILES

C1=CC=C(C=C1)OC(=NCCCCC2=NC=CN2)NC#N

InChI

InChI=1S/C15H17N5O/c16-12-20-15(21-13-6-2-1-3-7-13)19-9-5-4-8-14-17-10-11-18-14/h1-3,6-7,10-11H,4-5,8-9H2,(H,17,18)(H,19,20)