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

Systemtic Name: [4-[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]carbonylpiperazin-1-yl]-(furan-2-yl)methanone Openeye Name: [4-(1-benzyl-5-chloro-3-methyl-pyrazole-4-carbonyl)piperazin-1-yl]-(2-furyl)methanone CAS Name: [4-[[5-chloro-3-methyl-1-(phenylmethyl)-4-pyrazolyl]-oxomethyl]-1-piperazinyl]-(2-furanyl)methanone IUPAC Name: [4-(1-benzyl-5-chloro-3-methylpyrazole-4-carbonyl)piperazin-1-yl]-(furan-2-yl)methanone Traditional Name: [4-(1-benzyl-5-chloro-3-methyl-pyrazole-4-carbonyl)piperazino]-(2-furyl)methanone Formula: C21H21ClN4O3 MolecularWeight: 412.86944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)N2CCN(CC2)C(=O)C3=CC=CO3)Cl)CC4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C(=O)N2CCN(CC2)C(=O)C3=CC=CO3)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C21H21ClN4O3/c1-15-18(19(22)26(23-15)14-16-6-3-2-4-7-16)21(28)25-11-9-24(10-12-25)20(27)17-8-5-13-29-17/h2-8,13H,9-12,14H2,1H3