methyl 3-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]ethanoylamino]-3-thiophen-2-yl-propanoate

Systemtic Name: methyl 3-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]ethanoylamino]-3-thiophen-2-yl-propanoate Openeye Name: methyl 3-[[2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]acetyl]amino]-3-(2-thienyl)propanoate CAS Name: 3-[[2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-1-oxoethyl]amino]-3-thiophen-2-ylpropanoic acid methyl ester IUPAC Name: methyl 3-[[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]acetyl]amino]-3-thiophen-2-ylpropanoate Traditional Name: 3-[[2-[(3,5-dimethylisoxazol-4-yl)methylthio]acetyl]amino]-3-(2-thienyl)propionic acid methyl ester Formula: C16H20N2O4S2 MolecularWeight: 368.471

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSCC(=O)NC(CC(=O)OC)C2=CC=CS2

Isomeric SMILES

CC1=C(C(=NO1)C)CSCC(=O)NC(CC(=O)OC)C2=CC=CS2

InChI

InChI=1S/C16H20N2O4S2/c1-10-12(11(2)22-18-10)8-23-9-15(19)17-13(7-16(20)21-3)14-5-4-6-24-14/h4-6,13H,7-9H2,1-3H3,(H,17,19)