[1-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]pyrazol-3-yl]-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: [1-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]pyrazol-3-yl]-(4-phenylpiperazin-1-yl)methanone Openeye Name: [1-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]pyrazol-3-yl]-(4-phenylpiperazin-1-yl)methanone CAS Name: [1-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-3-pyrazolyl]-(4-phenyl-1-piperazinyl)methanone IUPAC Name: [1-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]pyrazol-3-yl]-(4-phenylpiperazin-1-yl)methanone Traditional Name: [1-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]pyrazol-3-yl]-(4-phenylpiperazino)methanone Formula: C20H23BrN6O MolecularWeight: 443.34022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CN2C=CC(=N2)C(=O)N3CCN(CC3)C4=CC=CC=C4)C)Br

Isomeric SMILES

CC1=C(C(=NN1CN2C=CC(=N2)C(=O)N3CCN(CC3)C4=CC=CC=C4)C)Br

InChI

InChI=1S/C20H23BrN6O/c1-15-19(21)16(2)27(22-15)14-26-9-8-18(23-26)20(28)25-12-10-24(11-13-25)17-6-4-3-5-7-17/h3-9H,10-14H2,1-2H3