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

Systemtic Name: [4-[5-chloranyl-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]carbonylpiperazin-1-yl]-thiophen-2-yl-methanone Openeye Name: [4-(5-chloro-1-isobutyl-3-methyl-pyrazole-4-carbonyl)piperazin-1-yl]-(2-thienyl)methanone CAS Name: [4-[[5-chloro-3-methyl-1-(2-methylpropyl)-4-pyrazolyl]-oxomethyl]-1-piperazinyl]-thiophen-2-ylmethanone IUPAC Name: [4-[5-chloro-3-methyl-1-(2-methylpropyl)pyrazole-4-carbonyl]piperazin-1-yl]-thiophen-2-ylmethanone Traditional Name: [4-(5-chloro-1-isobutyl-3-methyl-pyrazole-4-carbonyl)piperazino]-(2-thienyl)methanone Formula: C18H23ClN4O2S MolecularWeight: 394.91882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)N2CCN(CC2)C(=O)C3=CC=CS3)Cl)CC(C)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)N2CCN(CC2)C(=O)C3=CC=CS3)Cl)CC(C)C

InChI

InChI=1S/C18H23ClN4O2S/c1-12(2)11-23-16(19)15(13(3)20-23)18(25)22-8-6-21(7-9-22)17(24)14-5-4-10-26-14/h4-5,10,12H,6-9,11H2,1-3H3