3-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]-N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]propanamide

Systemtic Name: 3-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]-N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]propanamide Openeye Name: N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]-3-(1-isobutyl-3,5-dimethyl-pyrazol-4-yl)propanamide CAS Name: 3-[3,5-dimethyl-1-(2-methylpropyl)-4-pyrazolyl]-N-[4-(4-ethyl-1-piperazinyl)-2-methylphenyl]propanamide IUPAC Name: 3-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]-N-[4-(4-ethylpiperazin-1-yl)-2-methylphenyl]propanamide Traditional Name: N-[4-(4-ethylpiperazino)-2-methyl-phenyl]-3-(1-isobutyl-3,5-dimethyl-pyrazol-4-yl)propionamide Formula: C25H39N5O MolecularWeight: 425.61006

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC(=C(C=C2)NC(=O)CCC3=C(N(N=C3C)CC(C)C)C)C

Isomeric SMILES

CCN1CCN(CC1)C2=CC(=C(C=C2)NC(=O)CCC3=C(N(N=C3C)CC(C)C)C)C

InChI

InChI=1S/C25H39N5O/c1-7-28-12-14-29(15-13-28)22-8-10-24(19(4)16-22)26-25(31)11-9-23-20(5)27-30(21(23)6)17-18(2)3/h8,10,16,18H,7,9,11-15,17H2,1-6H3,(H,26,31)