methyl 2-[(3-methanoyl-2-pyridin-3-yl-1,3-thiazolidin-4-yl)carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl 2-[(3-methanoyl-2-pyridin-3-yl-1,3-thiazolidin-4-yl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl 2-[[3-formyl-2-(3-pyridyl)thiazolidine-4-carbonyl]amino]-4-methylsulfanyl-butanoate CAS Name: 2-[[[3-formyl-2-(3-pyridinyl)-4-thiazolidinyl]-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-[(3-formyl-2-pyridin-3-yl-1,3-thiazolidine-4-carbonyl)amino]-4-methylsulfanylbutanoate Traditional Name: 2-[[3-formyl-2-(3-pyridyl)thiazolidine-4-carbonyl]amino]-4-(methylthio)butyric acid methyl ester Formula: C16H21N3O4S2 MolecularWeight: 383.48564

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCSC)NC(=O)C1CSC(N1C=O)C2=CN=CC=C2

Isomeric SMILES

COC(=O)C(CCSC)NC(=O)C1CSC(N1C=O)C2=CN=CC=C2

InChI

InChI=1S/C16H21N3O4S2/c1-23-16(22)12(5-7-24-2)18-14(21)13-9-25-15(19(13)10-20)11-4-3-6-17-8-11/h3-4,6,8,10,12-13,15H,5,7,9H2,1-2H3,(H,18,21)