N-[(6-chloranylpyridin-3-yl)methyl]-2-(3-methylbutanoylamino)-1,3-thiazole-4-carboxamide

Systemtic Name: N-[(6-chloranylpyridin-3-yl)methyl]-2-(3-methylbutanoylamino)-1,3-thiazole-4-carboxamide Openeye Name: N-[(6-chloro-3-pyridyl)methyl]-2-(3-methylbutanoylamino)thiazole-4-carboxamide CAS Name: N-[(6-chloro-3-pyridinyl)methyl]-2-[(3-methyl-1-oxobutyl)amino]-4-thiazolecarboxamide IUPAC Name: N-[(6-chloropyridin-3-yl)methyl]-2-(3-methylbutanoylamino)-1,3-thiazole-4-carboxamide Traditional Name: N-[(6-chloro-3-pyridyl)methyl]-2-(isovalerylamino)thiazole-4-carboxamide Formula: C15H17ClN4O2S MolecularWeight: 352.83908

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=NC(=CS1)C(=O)NCC2=CN=C(C=C2)Cl

Isomeric SMILES

CC(C)CC(=O)NC1=NC(=CS1)C(=O)NCC2=CN=C(C=C2)Cl

InChI

InChI=1S/C15H17ClN4O2S/c1-9(2)5-13(21)20-15-19-11(8-23-15)14(22)18-7-10-3-4-12(16)17-6-10/h3-4,6,8-9H,5,7H2,1-2H3,(H,18,22)(H,19,20,21)