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

Systemtic Name: N-[(1S)-2-(2-methylbutan-2-ylamino)-2-oxidanylidene-1-pyridin-3-yl-ethyl]-N-phenyl-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-[(1S)-2-(1,1-dimethylpropylamino)-2-oxo-1-(3-pyridyl)ethyl]-N-phenyl-thiadiazole-4-carboxamide CAS Name: N-[(1S)-2-(2-methylbutan-2-ylamino)-2-oxo-1-(3-pyridinyl)ethyl]-N-phenyl-4-thiadiazolecarboxamide IUPAC Name: N-[(1S)-2-(2-methylbutan-2-ylamino)-2-oxo-1-pyridin-3-ylethyl]-N-phenylthiadiazole-4-carboxamide Traditional Name: N-[(1S)-2-(tert-amylamino)-2-keto-1-(3-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=CN=CC=C1)N(C2=CC=CC=C2)C(=O)C3=CSN=N3

Isomeric SMILES

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

InChI

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