N-[(1S)-2-(tert-butylamino)-2-oxidanylidene-1-pyridin-2-yl-ethyl]-N-prop-2-enyl-1,2,3-thiadiazole-4-carboxamide

Systemtic Name: N-[(1S)-2-(tert-butylamino)-2-oxidanylidene-1-pyridin-2-yl-ethyl]-N-prop-2-enyl-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-allyl-N-[(1S)-2-(tert-butylamino)-2-oxo-1-(2-pyridyl)ethyl]thiadiazole-4-carboxamide CAS Name: N-[(1S)-2-(tert-butylamino)-2-oxo-1-(2-pyridinyl)ethyl]-N-prop-2-enyl-4-thiadiazolecarboxamide IUPAC Name: N-[(1S)-2-(tert-butylamino)-2-oxo-1-pyridin-2-ylethyl]-N-prop-2-enylthiadiazole-4-carboxamide Traditional Name: N-allyl-N-[(1S)-2-(tert-butylamino)-2-keto-1-(2-pyridyl)ethyl]thiadiazole-4-carboxamide Formula: C17H21N5O2S MolecularWeight: 359.44594

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C(C1=CC=CC=N1)N(CC=C)C(=O)C2=CSN=N2

Isomeric SMILES

CC(C)(C)NC(=O)[C@H](C1=CC=CC=N1)N(CC=C)C(=O)C2=CSN=N2

InChI

InChI=1S/C17H21N5O2S/c1-5-10-22(16(24)13-11-25-21-20-13)14(12-8-6-7-9-18-12)15(23)19-17(2,3)4/h5-9,11,14H,1,10H2,2-4H3,(H,19,23)/t14-/m0/s1