N-(3,5-dimethylphenyl)-N-[2-(2-methylbutan-2-ylamino)-2-oxidanylidene-1-pyridin-4-yl-ethyl]-1,2,3-thiadiazole-4-carboxamide

Systemtic Name: N-(3,5-dimethylphenyl)-N-[2-(2-methylbutan-2-ylamino)-2-oxidanylidene-1-pyridin-4-yl-ethyl]-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-(3,5-dimethylphenyl)-N-[2-(1,1-dimethylpropylamino)-2-oxo-1-(4-pyridyl)ethyl]thiadiazole-4-carboxamide CAS Name: N-(3,5-dimethylphenyl)-N-[2-(2-methylbutan-2-ylamino)-2-oxo-1-pyridin-4-ylethyl]-4-thiadiazolecarboxamide IUPAC Name: N-(3,5-dimethylphenyl)-N-[2-(2-methylbutan-2-ylamino)-2-oxo-1-pyridin-4-ylethyl]thiadiazole-4-carboxamide Traditional Name: N-[2-(tert-amylamino)-2-keto-1-(4-pyridyl)ethyl]-N-(3,5-dimethylphenyl)thiadiazole-4-carboxamide Formula: C23H27N5O2S MolecularWeight: 437.55778

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)C(C1=CC=NC=C1)N(C2=CC(=CC(=C2)C)C)C(=O)C3=CSN=N3

Isomeric SMILES

CCC(C)(C)NC(=O)C(C1=CC=NC=C1)N(C2=CC(=CC(=C2)C)C)C(=O)C3=CSN=N3

InChI

InChI=1S/C23H27N5O2S/c1-6-23(4,5)25-21(29)20(17-7-9-24-10-8-17)28(22(30)19-14-31-27-26-19)18-12-15(2)11-16(3)13-18/h7-14,20H,6H2,1-5H3,(H,25,29)