2-oxidanyl-3-[2-(3-oxidanylidene-2-propan-2-yl-1,4-thiazin-4-yl)propanoylamino]-4-phenyl-butanoate

Systemtic Name: 2-oxidanyl-3-[2-(3-oxidanylidene-2-propan-2-yl-1,4-thiazin-4-yl)propanoylamino]-4-phenyl-butanoate Openeye Name: 2-hydroxy-3-[2-(2-isopropyl-3-oxo-1,4-thiazin-4-yl)propanoylamino]-4-phenyl-butanoate CAS Name: 2-hydroxy-3-[[1-oxo-2-(3-oxo-2-propan-2-yl-1,4-thiazin-4-yl)propyl]amino]-4-phenylbutanoate IUPAC Name: 2-hydroxy-3-[2-(3-oxo-2-propan-2-yl-1,4-thiazin-4-yl)propanoylamino]-4-phenylbutanoate Traditional Name: 2-hydroxy-3-[2-(2-isopropyl-3-keto-1,4-thiazin-4-yl)propanoylamino]-4-phenyl-butyrate Formula: C20H25N2O5S- MolecularWeight: 405.4879

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=O)N(C=CS1)C(C)C(=O)NC(CC2=CC=CC=C2)C(C(=O)[O-])O

Isomeric SMILES

CC(C)C1C(=O)N(C=CS1)C(C)C(=O)NC(CC2=CC=CC=C2)C(C(=O)[O-])O

InChI

InChI=1S/C20H26N2O5S/c1-12(2)17-19(25)22(9-10-28-17)13(3)18(24)21-15(16(23)20(26)27)11-14-7-5-4-6-8-14/h4-10,12-13,15-17,23H,11H2,1-3H3,(H,21,24)(H,26,27)/p-1