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

Systemtic Name: [5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]-(4-pyrazin-2-ylpiperazin-1-yl)methanone Openeye Name: (1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)-(4-pyrazin-2-ylpiperazin-1-yl)methanone CAS Name: [5-chloro-3-methyl-1-(phenylmethyl)-4-pyrazolyl]-[4-(2-pyrazinyl)-1-piperazinyl]methanone IUPAC Name: (1-benzyl-5-chloro-3-methylpyrazol-4-yl)-(4-pyrazin-2-ylpiperazin-1-yl)methanone Traditional Name: (1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)-(4-pyrazin-2-ylpiperazino)methanone Formula: C20H21ClN6O MolecularWeight: 396.87334

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21ClN6O/c1-15-18(19(21)27(24-15)14-16-5-3-2-4-6-16)20(28)26-11-9-25(10-12-26)17-13-22-7-8-23-17/h2-8,13H,9-12,14H2,1H3