methyl 3-[2-[1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxidanylidene-propan-2-yl]sulfanylethanoylamino]-3-phenyl-propanoate

Systemtic Name: methyl 3-[2-[1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxidanylidene-propan-2-yl]sulfanylethanoylamino]-3-phenyl-propanoate Openeye Name: methyl 3-[[2-[1-methyl-2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl]sulfanylacetyl]amino]-3-phenyl-propanoate CAS Name: 3-[[2-[[1-[(5-methyl-3-isoxazolyl)amino]-1-oxopropan-2-yl]thio]-1-oxoethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 3-[[2-[1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxopropan-2-yl]sulfanylacetyl]amino]-3-phenylpropanoate Traditional Name: 3-[[2-[[2-keto-1-methyl-2-[(5-methylisoxazol-3-yl)amino]ethyl]thio]acetyl]amino]-3-phenyl-propionic acid methyl ester Formula: C19H23N3O5S MolecularWeight: 405.46802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C(C)SCC(=O)NC(CC(=O)OC)C2=CC=CC=C2

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C(C)SCC(=O)NC(CC(=O)OC)C2=CC=CC=C2

InChI

InChI=1S/C19H23N3O5S/c1-12-9-16(22-27-12)21-19(25)13(2)28-11-17(23)20-15(10-18(24)26-3)14-7-5-4-6-8-14/h4-9,13,15H,10-11H2,1-3H3,(H,20,23)(H,21,22,25)