phenyl N-cyano-N'-[3-(1H-imidazol-2-yl)propyl]carbamimidate

Systemtic Name: phenyl N-cyano-N'-[3-(1H-imidazol-2-yl)propyl]carbamimidate Openeye Name: 1-cyano-3-[3-(1H-imidazol-2-yl)propyl]-2-phenyl-isourea CAS Name: N-cyano-N'-[3-(1H-imidazol-2-yl)propyl]carbamimidic acid phenyl ester IUPAC Name: phenyl N-cyano-N'-[3-(1H-imidazol-2-yl)propyl]carbamimidate Traditional Name: 1-cyano-3-[3-(1H-imidazol-2-yl)propyl]-2-phenyl-isourea Formula: C14H15N5O MolecularWeight: 269.3018

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(=NCCCC2=NC=CN2)NC#N

Isomeric SMILES

C1=CC=C(C=C1)OC(=NCCCC2=NC=CN2)NC#N

InChI

InChI=1S/C14H15N5O/c15-11-19-14(20-12-5-2-1-3-6-12)18-8-4-7-13-16-9-10-17-13/h1-3,5-6,9-10H,4,7-8H2,(H,16,17)(H,18,19)