5-(4-methylphenyl)carbonylimino-2-[3-(trifluoromethyl)phenyl]-1,2,3-thiadiazole-4-carboxamide

Systemtic Name: 5-(4-methylphenyl)carbonylimino-2-[3-(trifluoromethyl)phenyl]-1,2,3-thiadiazole-4-carboxamide Openeye Name: 5-(4-methylbenzoyl)imino-2-[3-(trifluoromethyl)phenyl]thiadiazole-4-carboxamide CAS Name: 5-[(4-methylphenyl)-oxomethyl]imino-2-[3-(trifluoromethyl)phenyl]-4-thiadiazolecarboxamide IUPAC Name: 5-(4-methylbenzoyl)imino-2-[3-(trifluoromethyl)phenyl]thiadiazole-4-carboxamide Traditional Name: 5-p-toluoylimino-2-[3-(trifluoromethyl)phenyl]thiadiazole-4-carboxamide Formula: C18H13F3N4O2S MolecularWeight: 406.38163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N=C2C(=NN(S2)C3=CC=CC(=C3)C(F)(F)F)C(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N=C2C(=NN(S2)C3=CC=CC(=C3)C(F)(F)F)C(=O)N

InChI

InChI=1S/C18H13F3N4O2S/c1-10-5-7-11(8-6-10)16(27)23-17-14(15(22)26)24-25(28-17)13-4-2-3-12(9-13)18(19,20)21/h2-9H,1H3,(H2,22,26)