(3,5-dimethyl-1,2-oxazol-4-yl)methyl 4-(1,3-benzothiazol-2-yl)butanoate

Systemtic Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 4-(1,3-benzothiazol-2-yl)butanoate Openeye Name: (3,5-dimethylisoxazol-4-yl)methyl 4-(1,3-benzothiazol-2-yl)butanoate CAS Name: 4-(1,3-benzothiazol-2-yl)butanoic acid (3,5-dimethyl-4-isoxazolyl)methyl ester IUPAC Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 4-(1,3-benzothiazol-2-yl)butanoate Traditional Name: 4-(1,3-benzothiazol-2-yl)butyric acid (3,5-dimethylisoxazol-4-yl)methyl ester Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)COC(=O)CCCC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=C(C(=NO1)C)COC(=O)CCCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H18N2O3S/c1-11-13(12(2)22-19-11)10-21-17(20)9-5-8-16-18-14-6-3-4-7-15(14)23-16/h3-4,6-7H,5,8-10H2,1-2H3