ethyl 2-[4-(phenylmethylsulfanyl)butanoylamino]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[4-(phenylmethylsulfanyl)butanoylamino]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-(4-benzylsulfanylbutanoylamino)thiazole-4-carboxylate CAS Name: 2-[[1-oxo-4-(phenylmethylthio)butyl]amino]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-benzylsulfanylbutanoylamino)-1,3-thiazole-4-carboxylate Traditional Name: 2-[4-(benzylthio)butanoylamino]thiazole-4-carboxylic acid ethyl ester Formula: C17H20N2O3S2 MolecularWeight: 364.4823

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)NC(=O)CCCSCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)NC(=O)CCCSCC2=CC=CC=C2

InChI

InChI=1S/C17H20N2O3S2/c1-2-22-16(21)14-12-24-17(18-14)19-15(20)9-6-10-23-11-13-7-4-3-5-8-13/h3-5,7-8,12H,2,6,9-11H2,1H3,(H,18,19,20)