2-[2-[5-methoxy-2-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]-4-oxidanylidene-pyridin-1-yl]ethanoylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[2-[5-methoxy-2-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]-4-oxidanylidene-pyridin-1-yl]ethanoylamino]-3-methyl-butanoic acid Openeye Name: 2-[[2-[5-methoxy-2-[(4-methylthiazol-2-yl)sulfanylmethyl]-4-oxo-1-pyridyl]acetyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[2-[5-methoxy-2-[[(4-methyl-2-thiazolyl)thio]methyl]-4-oxo-1-pyridinyl]-1-oxoethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[2-[5-methoxy-2-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]-4-oxopyridin-1-yl]acetyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[2-[4-keto-5-methoxy-2-[[(4-methylthiazol-2-yl)thio]methyl]-1-pyridyl]acetyl]amino]-3-methyl-butyric acid Formula: C18H23N3O5S2 MolecularWeight: 425.52232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)SCC2=CC(=O)C(=CN2CC(=O)NC(C(C)C)C(=O)O)OC

Isomeric SMILES

CC1=CSC(=N1)SCC2=CC(=O)C(=CN2CC(=O)NC(C(C)C)C(=O)O)OC

InChI

InChI=1S/C18H23N3O5S2/c1-10(2)16(17(24)25)20-15(23)7-21-6-14(26-4)13(22)5-12(21)9-28-18-19-11(3)8-27-18/h5-6,8,10,16H,7,9H2,1-4H3,(H,20,23)(H,24,25)