3-(4-methylphenyl)-1-[(4-methylphenyl)methyl]-N-(1,3,4-thiadiazol-2-yl)pyrazole-4-carboxamide

Systemtic Name: 3-(4-methylphenyl)-1-[(4-methylphenyl)methyl]-N-(1,3,4-thiadiazol-2-yl)pyrazole-4-carboxamide Openeye Name: 3-(p-tolyl)-1-(p-tolylmethyl)-N-(1,3,4-thiadiazol-2-yl)pyrazole-4-carboxamide CAS Name: 3-(4-methylphenyl)-1-[(4-methylphenyl)methyl]-N-(1,3,4-thiadiazol-2-yl)-4-pyrazolecarboxamide IUPAC Name: 3-(4-methylphenyl)-1-[(4-methylphenyl)methyl]-N-(1,3,4-thiadiazol-2-yl)pyrazole-4-carboxamide Traditional Name: 1-(4-methylbenzyl)-3-(p-tolyl)-N-(1,3,4-thiadiazol-2-yl)pyrazole-4-carboxamide Formula: C21H19N5OS MolecularWeight: 389.47346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=C(C=C3)C)C(=O)NC4=NN=CS4

Isomeric SMILES

CC1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=C(C=C3)C)C(=O)NC4=NN=CS4

InChI

InChI=1S/C21H19N5OS/c1-14-3-7-16(8-4-14)11-26-12-18(20(27)23-21-24-22-13-28-21)19(25-26)17-9-5-15(2)6-10-17/h3-10,12-13H,11H2,1-2H3,(H,23,24,27)