phenyl N-cyano-N-[3-[(5-methylpyridin-2-yl)methylamino]propyl]carbamimidate

Systemtic Name: phenyl N-cyano-N-[3-[(5-methylpyridin-2-yl)methylamino]propyl]carbamimidate Openeye Name: 1-cyano-1-[3-[(5-methyl-2-pyridyl)methylamino]propyl]-2-phenyl-isourea CAS Name: N-cyano-N-[3-[(5-methyl-2-pyridinyl)methylamino]propyl]carbamimidic acid phenyl ester IUPAC Name: phenyl N-cyano-N-[3-[(5-methylpyridin-2-yl)methylamino]propyl]carbamimidate Traditional Name: 1-cyano-1-[3-[(5-methyl-2-pyridyl)methylamino]propyl]-2-phenyl-isourea Formula: C18H21N5O MolecularWeight: 323.39224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)CNCCCN(C#N)C(=N)OC2=CC=CC=C2

Isomeric SMILES

CC1=CN=C(C=C1)CNCCCN(C#N)C(=N)OC2=CC=CC=C2

InChI

InChI=1S/C18H21N5O/c1-15-8-9-16(22-12-15)13-21-10-5-11-23(14-19)18(20)24-17-6-3-2-4-7-17/h2-4,6-9,12,20-21H,5,10-11,13H2,1H3