N-[4-bromanyl-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-4-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]thiophene-2-carboxamide

Systemtic Name: N-[4-bromanyl-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-4-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]thiophene-2-carboxamide Openeye Name: N-[4-bromo-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-4-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]thiophene-2-carboxamide CAS Name: N-[4-bromo-1-[(2-fluorophenyl)methyl]-3-pyrazolyl]-4-[(5-methyl-3-nitro-1-pyrazolyl)methyl]-2-thiophenecarboxamide IUPAC Name: N-[4-bromo-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-4-[(5-methyl-3-nitropyrazol-1-yl)methyl]thiophene-2-carboxamide Traditional Name: N-[4-bromo-1-(2-fluorobenzyl)pyrazol-3-yl]-4-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]thiophene-2-carboxamide Formula: C20H16BrFN6O3S MolecularWeight: 519.346843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC2=CSC(=C2)C(=O)NC3=NN(C=C3Br)CC4=CC=CC=C4F)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NN1CC2=CSC(=C2)C(=O)NC3=NN(C=C3Br)CC4=CC=CC=C4F)[N+](=O)[O-]

InChI

InChI=1S/C20H16BrFN6O3S/c1-12-6-18(28(30)31)24-27(12)8-13-7-17(32-11-13)20(29)23-19-15(21)10-26(25-19)9-14-4-2-3-5-16(14)22/h2-7,10-11H,8-9H2,1H3,(H,23,25,29)