2,4-dimethyl-N-[(1S)-2-(2-methylbutan-2-ylamino)-2-oxidanylidene-1-pyridin-4-yl-ethyl]-N-prop-2-ynyl-1,3-thiazole-5-carboxamide

Systemtic Name: 2,4-dimethyl-N-[(1S)-2-(2-methylbutan-2-ylamino)-2-oxidanylidene-1-pyridin-4-yl-ethyl]-N-prop-2-ynyl-1,3-thiazole-5-carboxamide Openeye Name: N-[(1S)-2-(1,1-dimethylpropylamino)-2-oxo-1-(4-pyridyl)ethyl]-2,4-dimethyl-N-prop-2-ynyl-thiazole-5-carboxamide CAS Name: 2,4-dimethyl-N-[(1S)-2-(2-methylbutan-2-ylamino)-2-oxo-1-pyridin-4-ylethyl]-N-prop-2-ynyl-5-thiazolecarboxamide IUPAC Name: 2,4-dimethyl-N-[(1S)-2-(2-methylbutan-2-ylamino)-2-oxo-1-pyridin-4-ylethyl]-N-prop-2-ynyl-1,3-thiazole-5-carboxamide Traditional Name: N-[(1S)-2-(tert-amylamino)-2-keto-1-(4-pyridyl)ethyl]-2,4-dimethyl-N-propargyl-thiazole-5-carboxamide Formula: C21H26N4O2S MolecularWeight: 398.52174

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)C(C1=CC=NC=C1)N(CC#C)C(=O)C2=C(N=C(S2)C)C

Isomeric SMILES

CCC(C)(C)NC(=O)[C@H](C1=CC=NC=C1)N(CC#C)C(=O)C2=C(N=C(S2)C)C

InChI

InChI=1S/C21H26N4O2S/c1-7-13-25(20(27)18-14(3)23-15(4)28-18)17(16-9-11-22-12-10-16)19(26)24-21(5,6)8-2/h1,9-12,17H,8,13H2,2-6H3,(H,24,26)/t17-/m0/s1