N-[(3,5-dimethyl-4-piperidin-1-ylsulfonyl-pyrazol-1-yl)methyl]-N-[(4-fluorophenyl)methyl]cyclopropanamine

Systemtic Name: N-[(3,5-dimethyl-4-piperidin-1-ylsulfonyl-pyrazol-1-yl)methyl]-N-[(4-fluorophenyl)methyl]cyclopropanamine Openeye Name: N-[[3,5-dimethyl-4-(1-piperidylsulfonyl)pyrazol-1-yl]methyl]-N-[(4-fluorophenyl)methyl]cyclopropanamine CAS Name: N-[[3,5-dimethyl-4-(1-piperidinylsulfonyl)-1-pyrazolyl]methyl]-N-[(4-fluorophenyl)methyl]cyclopropanamine IUPAC Name: N-[(3,5-dimethyl-4-piperidin-1-ylsulfonylpyrazol-1-yl)methyl]-N-[(4-fluorophenyl)methyl]cyclopropanamine Traditional Name: cyclopropyl-[(3,5-dimethyl-4-piperidinosulfonyl-pyrazol-1-yl)methyl]-(4-fluorobenzyl)amine Formula: C21H29FN4O2S MolecularWeight: 420.543963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CN(CC2=CC=C(C=C2)F)C3CC3)C)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C(=NN1CN(CC2=CC=C(C=C2)F)C3CC3)C)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C21H29FN4O2S/c1-16-21(29(27,28)25-12-4-3-5-13-25)17(2)26(23-16)15-24(20-10-11-20)14-18-6-8-19(22)9-7-18/h6-9,20H,3-5,10-15H2,1-2H3