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

Systemtic Name: N-[(1S)-2-(2-methylbutan-2-ylamino)-2-oxidanylidene-1-pyridin-2-yl-ethyl]-N-phenyl-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-[(1S)-2-(1,1-dimethylpropylamino)-2-oxo-1-(2-pyridyl)ethyl]-N-phenyl-thiadiazole-4-carboxamide CAS Name: N-[(1S)-2-(2-methylbutan-2-ylamino)-2-oxo-1-(2-pyridinyl)ethyl]-N-phenyl-4-thiadiazolecarboxamide IUPAC Name: N-[(1S)-2-(2-methylbutan-2-ylamino)-2-oxo-1-pyridin-2-ylethyl]-N-phenylthiadiazole-4-carboxamide Traditional Name: N-[(1S)-2-(tert-amylamino)-2-keto-1-(2-pyridyl)ethyl]-N-phenyl-thiadiazole-4-carboxamide Formula: C21H23N5O2S MolecularWeight: 409.50462

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)C(C1=CC=CC=N1)N(C2=CC=CC=C2)C(=O)C3=CSN=N3

Isomeric SMILES

CCC(C)(C)NC(=O)[C@H](C1=CC=CC=N1)N(C2=CC=CC=C2)C(=O)C3=CSN=N3

InChI

InChI=1S/C21H23N5O2S/c1-4-21(2,3)23-19(27)18(16-12-8-9-13-22-16)26(15-10-6-5-7-11-15)20(28)17-14-29-25-24-17/h5-14,18H,4H2,1-3H3,(H,23,27)/t18-/m0/s1