[5-chloranyl-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]-[4-(2-ethoxyphenyl)piperazin-1-yl]methanone

Systemtic Name: [5-chloranyl-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]-[4-(2-ethoxyphenyl)piperazin-1-yl]methanone Openeye Name: (5-chloro-1-isobutyl-3-methyl-pyrazol-4-yl)-[4-(2-ethoxyphenyl)piperazin-1-yl]methanone CAS Name: [5-chloro-3-methyl-1-(2-methylpropyl)-4-pyrazolyl]-[4-(2-ethoxyphenyl)-1-piperazinyl]methanone IUPAC Name: [5-chloro-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]-[4-(2-ethoxyphenyl)piperazin-1-yl]methanone Traditional Name: (5-chloro-1-isobutyl-3-methyl-pyrazol-4-yl)-(4-o-phenetylpiperazino)methanone Formula: C21H29ClN4O2 MolecularWeight: 404.93356

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)C3=C(N(N=C3C)CC(C)C)Cl

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)C3=C(N(N=C3C)CC(C)C)Cl

InChI

InChI=1S/C21H29ClN4O2/c1-5-28-18-9-7-6-8-17(18)24-10-12-25(13-11-24)21(27)19-16(4)23-26(20(19)22)14-15(2)3/h6-9,15H,5,10-14H2,1-4H3