1-cyano-1-[[1-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]piperidin-4-yl]methyl]-2-propyl-guanidine

Systemtic Name: 1-cyano-1-[[1-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]piperidin-4-yl]methyl]-2-propyl-guanidine Openeye Name: 1-cyano-1-[[1-[4-(4-fluorophenyl)-4-oxo-butyl]-4-piperidyl]methyl]-2-propyl-guanidine CAS Name: 1-cyano-1-[[1-[4-(4-fluorophenyl)-4-oxobutyl]-4-piperidinyl]methyl]-2-propylguanidine IUPAC Name: 1-cyano-1-[[1-[4-(4-fluorophenyl)-4-oxobutyl]piperidin-4-yl]methyl]-2-propylguanidine Traditional Name: 1-cyano-1-[[1-[4-(4-fluorophenyl)-4-keto-butyl]-4-piperidyl]methyl]-2-propyl-guanidine Formula: C21H30FN5O MolecularWeight: 387.494203

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Descriptors Computed from Structure

Canonical SMILES:

CCCN=C(N)N(CC1CCN(CC1)CCCC(=O)C2=CC=C(C=C2)F)C#N

Isomeric SMILES

CCCN=C(N)N(CC1CCN(CC1)CCCC(=O)C2=CC=C(C=C2)F)C#N

InChI

InChI=1S/C21H30FN5O/c1-2-11-25-21(24)27(16-23)15-17-9-13-26(14-10-17)12-3-4-20(28)18-5-7-19(22)8-6-18/h5-8,17H,2-4,9-15H2,1H3,(H2,24,25)