1-cyano-3-(4-methoxyphenyl)-2-[3-(4-methylimidazol-1-yl)propyl]guanidine

Systemtic Name: 1-cyano-3-(4-methoxyphenyl)-2-[3-(4-methylimidazol-1-yl)propyl]guanidine Openeye Name: 1-cyano-3-(4-methoxyphenyl)-2-[3-(4-methylimidazol-1-yl)propyl]guanidine CAS Name: 1-cyano-3-(4-methoxyphenyl)-2-[3-(4-methyl-1-imidazolyl)propyl]guanidine IUPAC Name: 1-cyano-3-(4-methoxyphenyl)-2-[3-(4-methylimidazol-1-yl)propyl]guanidine Traditional Name: 1-cyano-3-(4-methoxyphenyl)-2-[3-(4-methylimidazol-1-yl)propyl]guanidine Formula: C16H20N6O MolecularWeight: 312.3696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C=N1)CCCN=C(NC#N)NC2=CC=C(C=C2)OC

Isomeric SMILES

CC1=CN(C=N1)CCCN=C(NC#N)NC2=CC=C(C=C2)OC

InChI

InChI=1S/C16H20N6O/c1-13-10-22(12-20-13)9-3-8-18-16(19-11-17)21-14-4-6-15(23-2)7-5-14/h4-7,10,12H,3,8-9H2,1-2H3,(H2,18,19,21)