N-[[5-chloranyl-1-[(4-fluorophenyl)methyl]-3-methyl-pyrazol-4-yl]methylideneamino]phthalazin-1-amine

Systemtic Name: N-[[5-chloranyl-1-[(4-fluorophenyl)methyl]-3-methyl-pyrazol-4-yl]methylideneamino]phthalazin-1-amine Openeye Name: N-[[5-chloro-1-[(4-fluorophenyl)methyl]-3-methyl-pyrazol-4-yl]methyleneamino]phthalazin-1-amine CAS Name: N-[[5-chloro-1-[(4-fluorophenyl)methyl]-3-methyl-4-pyrazolyl]methylideneamino]-1-phthalazinamine IUPAC Name: N-[[5-chloro-1-[(4-fluorophenyl)methyl]-3-methylpyrazol-4-yl]methylideneamino]phthalazin-1-amine Traditional Name: [[5-chloro-1-(4-fluorobenzyl)-3-methyl-pyrazol-4-yl]methyleneamino]-phthalazin-1-yl-amine Formula: C20H16ClFN6 MolecularWeight: 394.832643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=NNC2=NN=CC3=CC=CC=C32)Cl)CC4=CC=C(C=C4)F

Isomeric SMILES

CC1=NN(C(=C1C=NNC2=NN=CC3=CC=CC=C32)Cl)CC4=CC=C(C=C4)F

InChI

InChI=1S/C20H16ClFN6/c1-13-18(19(21)28(27-13)12-14-6-8-16(22)9-7-14)11-24-26-20-17-5-3-2-4-15(17)10-23-25-20/h2-11H,12H2,1H3,(H,25,26)