N-[3-cyano-4-[4-(3-oxidanylpropyl)piperazin-1-yl]phenyl]-1-(4-fluorophenyl)-5-methyl-pyrazole-4-carboxamide hydrochloride

Systemtic Name: N-[3-cyano-4-[4-(3-oxidanylpropyl)piperazin-1-yl]phenyl]-1-(4-fluorophenyl)-5-methyl-pyrazole-4-carboxamide hydrochloride Openeye Name: N-[3-cyano-4-[4-(3-hydroxypropyl)piperazin-1-yl]phenyl]-1-(4-fluorophenyl)-5-methyl-pyrazole-4-carboxamide hydrochloride CAS Name: N-[3-cyano-4-[4-(3-hydroxypropyl)-1-piperazinyl]phenyl]-1-(4-fluorophenyl)-5-methyl-4-pyrazolecarboxamide hydrochloride IUPAC Name: N-[3-cyano-4-[4-(3-hydroxypropyl)piperazin-1-yl]phenyl]-1-(4-fluorophenyl)-5-methylpyrazole-4-carboxamide hydrochloride Traditional Name: N-[3-cyano-4-[4-(3-hydroxypropyl)piperazino]phenyl]-1-(4-fluorophenyl)-5-methyl-pyrazole-4-carboxamide hydrochloride Formula: C25H28ClFN6O2 MolecularWeight: 498.980223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=C(C=C2)F)C(=O)NC3=CC(=C(C=C3)N4CCN(CC4)CCCO)C#N.Cl

Isomeric SMILES

CC1=C(C=NN1C2=CC=C(C=C2)F)C(=O)NC3=CC(=C(C=C3)N4CCN(CC4)CCCO)C#N.Cl

InChI

InChI=1S/C25H27FN6O2.ClH/c1-18-23(17-28-32(18)22-6-3-20(26)4-7-22)25(34)29-21-5-8-24(19(15-21)16-27)31-12-10-30(11-13-31)9-2-14-33;/h3-8,15,17,33H,2,9-14H2,1H3,(H,29,34);1H