N-[(4-carbamimidoylphenyl)methyl]-5-chloranyl-1-[(4-fluorophenyl)methyl]-3-methyl-pyrazole-4-carboxamide

Systemtic Name: N-[(4-carbamimidoylphenyl)methyl]-5-chloranyl-1-[(4-fluorophenyl)methyl]-3-methyl-pyrazole-4-carboxamide Openeye Name: N-[(4-carbamimidoylphenyl)methyl]-5-chloro-1-[(4-fluorophenyl)methyl]-3-methyl-pyrazole-4-carboxamide CAS Name: N-[(4-carbamimidoylphenyl)methyl]-5-chloro-1-[(4-fluorophenyl)methyl]-3-methyl-4-pyrazolecarboxamide IUPAC Name: N-[(4-carbamimidoylphenyl)methyl]-5-chloro-1-[(4-fluorophenyl)methyl]-3-methylpyrazole-4-carboxamide Traditional Name: N-(4-amidinobenzyl)-5-chloro-1-(4-fluorobenzyl)-3-methyl-pyrazole-4-carboxamide Formula: C20H19ClFN5O MolecularWeight: 399.849163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NCC2=CC=C(C=C2)C(=N)N)Cl)CC3=CC=C(C=C3)F

Isomeric SMILES

CC1=NN(C(=C1C(=O)NCC2=CC=C(C=C2)C(=N)N)Cl)CC3=CC=C(C=C3)F

InChI

InChI=1S/C20H19ClFN5O/c1-12-17(18(21)27(26-12)11-14-4-8-16(22)9-5-14)20(28)25-10-13-2-6-15(7-3-13)19(23)24/h2-9H,10-11H2,1H3,(H3,23,24)(H,25,28)