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

Systemtic Name: methyl 4-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]acetyl]amino]benzoate CAS Name: 4-[[2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]acetyl]amino]benzoate Traditional Name: 4-[[2-[(3,5-dimethylisoxazol-4-yl)methylthio]acetyl]amino]benzoic acid methyl ester Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSCC(=O)NC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC1=C(C(=NO1)C)CSCC(=O)NC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C16H18N2O4S/c1-10-14(11(2)22-18-10)8-23-9-15(19)17-13-6-4-12(5-7-13)16(20)21-3/h4-7H,8-9H2,1-3H3,(H,17,19)