N-[(4-dimethylaminophenyl)methyl]-1-(4-fluorophenyl)-N-methyl-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide

Systemtic Name: N-[(4-dimethylaminophenyl)methyl]-1-(4-fluorophenyl)-N-methyl-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide Openeye Name: N-[(4-dimethylaminophenyl)methyl]-1-(4-fluorophenyl)-N-methyl-5-(2-thienyl)-1,2,4-triazole-3-carboxamide CAS Name: N-[(4-dimethylaminophenyl)methyl]-1-(4-fluorophenyl)-N-methyl-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide IUPAC Name: N-[(4-dimethylaminophenyl)methyl]-1-(4-fluorophenyl)-N-methyl-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide Traditional Name: N-[4-(dimethylamino)benzyl]-1-(4-fluorophenyl)-N-methyl-5-(2-thienyl)-1,2,4-triazole-3-carboxamide Formula: C23H22FN5OS MolecularWeight: 435.517083

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CN(C)C(=O)C2=NN(C(=N2)C3=CC=CS3)C4=CC=C(C=C4)F

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CN(C)C(=O)C2=NN(C(=N2)C3=CC=CS3)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H22FN5OS/c1-27(2)18-10-6-16(7-11-18)15-28(3)23(30)21-25-22(20-5-4-14-31-20)29(26-21)19-12-8-17(24)9-13-19/h4-14H,15H2,1-3H3