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

Systemtic Name: 1-cyano-2-cyclopropyl-1-[[1-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]piperidin-4-yl]methyl]guanidine Openeye Name: 1-cyano-2-cyclopropyl-1-[[1-[4-(4-fluorophenyl)-4-oxo-butyl]-4-piperidyl]methyl]guanidine CAS Name: 1-cyano-2-cyclopropyl-1-[[1-[4-(4-fluorophenyl)-4-oxobutyl]-4-piperidinyl]methyl]guanidine IUPAC Name: 1-cyano-2-cyclopropyl-1-[[1-[4-(4-fluorophenyl)-4-oxobutyl]piperidin-4-yl]methyl]guanidine Traditional Name: 1-cyano-2-cyclopropyl-1-[[1-[4-(4-fluorophenyl)-4-keto-butyl]-4-piperidyl]methyl]guanidine Formula: C21H28FN5O MolecularWeight: 385.478323

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N=C(N)N(CC2CCN(CC2)CCCC(=O)C3=CC=C(C=C3)F)C#N

Isomeric SMILES

C1CC1N=C(N)N(CC2CCN(CC2)CCCC(=O)C3=CC=C(C=C3)F)C#N

InChI

InChI=1S/C21H28FN5O/c22-18-5-3-17(4-6-18)20(28)2-1-11-26-12-9-16(10-13-26)14-27(15-23)21(24)25-19-7-8-19/h3-6,16,19H,1-2,7-14H2,(H2,24,25)