ethyl 1-[[2-(3-methylbutanoylamino)-1,3-thiazol-4-yl]carbonyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[[2-(3-methylbutanoylamino)-1,3-thiazol-4-yl]carbonyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[2-(3-methylbutanoylamino)thiazole-4-carbonyl]piperidine-3-carboxylate CAS Name: 1-[[2-[(3-methyl-1-oxobutyl)amino]-4-thiazolyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(3-methylbutanoylamino)-1,3-thiazole-4-carbonyl]piperidine-3-carboxylate Traditional Name: 1-[2-(isovalerylamino)thiazole-4-carbonyl]nipecotic acid ethyl ester Formula: C17H25N3O4S MolecularWeight: 367.4631

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=CSC(=N2)NC(=O)CC(C)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2=CSC(=N2)NC(=O)CC(C)C

InChI

InChI=1S/C17H25N3O4S/c1-4-24-16(23)12-6-5-7-20(9-12)15(22)13-10-25-17(18-13)19-14(21)8-11(2)3/h10-12H,4-9H2,1-3H3,(H,18,19,21)