N-(4-iodanyl-2-methyl-phenyl)-1-phenyl-3-thiophen-2-yl-pyrazole-4-carboxamide

Systemtic Name: N-(4-iodanyl-2-methyl-phenyl)-1-phenyl-3-thiophen-2-yl-pyrazole-4-carboxamide Openeye Name: N-(4-iodo-2-methyl-phenyl)-1-phenyl-3-(2-thienyl)pyrazole-4-carboxamide CAS Name: N-(4-iodo-2-methylphenyl)-1-phenyl-3-thiophen-2-yl-4-pyrazolecarboxamide IUPAC Name: N-(4-iodo-2-methylphenyl)-1-phenyl-3-thiophen-2-ylpyrazole-4-carboxamide Traditional Name: N-(4-iodo-2-methyl-phenyl)-1-phenyl-3-(2-thienyl)pyrazole-4-carboxamide Formula: C21H16IN3OS MolecularWeight: 485.34071

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC(=O)C2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC(=O)C2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C21H16IN3OS/c1-14-12-15(22)9-10-18(14)23-21(26)17-13-25(16-6-3-2-4-7-16)24-20(17)19-8-5-11-27-19/h2-13H,1H3,(H,23,26)