N-(4-chlorophenyl)-5-[(2-methylbutan-2-ylamino)methyl]-1,3,4-thiadiazole-2-carboxamide

Systemtic Name: N-(4-chlorophenyl)-5-[(2-methylbutan-2-ylamino)methyl]-1,3,4-thiadiazole-2-carboxamide Openeye Name: N-(4-chlorophenyl)-5-[(1,1-dimethylpropylamino)methyl]-1,3,4-thiadiazole-2-carboxamide CAS Name: N-(4-chlorophenyl)-5-[(2-methylbutan-2-ylamino)methyl]-1,3,4-thiadiazole-2-carboxamide IUPAC Name: N-(4-chlorophenyl)-5-[(2-methylbutan-2-ylamino)methyl]-1,3,4-thiadiazole-2-carboxamide Traditional Name: 5-[(tert-amylamino)methyl]-N-(4-chlorophenyl)-1,3,4-thiadiazole-2-carboxamide Formula: C15H19ClN4OS MolecularWeight: 338.85556

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NCC1=NN=C(S1)C(=O)NC2=CC=C(C=C2)Cl

Isomeric SMILES

CCC(C)(C)NCC1=NN=C(S1)C(=O)NC2=CC=C(C=C2)Cl

InChI

InChI=1S/C15H19ClN4OS/c1-4-15(2,3)17-9-12-19-20-14(22-12)13(21)18-11-7-5-10(16)6-8-11/h5-8,17H,4,9H2,1-3H3,(H,18,21)