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

Systemtic Name: butyl 4-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]ethanoylamino]benzoate Openeye Name: butyl 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 butyl ester IUPAC Name: butyl 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 butyl ester Formula: C19H24N2O4S MolecularWeight: 376.46986

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CSCC2=C(ON=C2C)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CSCC2=C(ON=C2C)C

InChI

InChI=1S/C19H24N2O4S/c1-4-5-10-24-19(23)15-6-8-16(9-7-15)20-18(22)12-26-11-17-13(2)21-25-14(17)3/h6-9H,4-5,10-12H2,1-3H3,(H,20,22)