methyl 4-[[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]pyridin-3-yl]carbonylamino]butanoate

Systemtic Name: methyl 4-[[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]pyridin-3-yl]carbonylamino]butanoate Openeye Name: methyl 4-[[2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]pyridine-3-carbonyl]amino]butanoate CAS Name: 4-[[[2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-3-pyridinyl]-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]pyridine-3-carbonyl]amino]butanoate Traditional Name: 4-[[2-[(3,5-dimethylisoxazol-4-yl)methylthio]nicotinoyl]amino]butyric acid methyl ester Formula: C17H21N3O4S MolecularWeight: 363.43134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSC2=C(C=CC=N2)C(=O)NCCCC(=O)OC

Isomeric SMILES

CC1=C(C(=NO1)C)CSC2=C(C=CC=N2)C(=O)NCCCC(=O)OC

InChI

InChI=1S/C17H21N3O4S/c1-11-14(12(2)24-20-11)10-25-17-13(6-4-9-19-17)16(22)18-8-5-7-15(21)23-3/h4,6,9H,5,7-8,10H2,1-3H3,(H,18,22)