N-(2,6-dimethylphenyl)-4-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methylsulfanyl]butanamide

Systemtic Name: N-(2,6-dimethylphenyl)-4-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methylsulfanyl]butanamide Openeye Name: N-(2,6-dimethylphenyl)-4-[[3-(4-methoxyphenyl)isoxazol-5-yl]methylsulfanyl]butanamide CAS Name: N-(2,6-dimethylphenyl)-4-[[3-(4-methoxyphenyl)-5-isoxazolyl]methylthio]butanamide IUPAC Name: N-(2,6-dimethylphenyl)-4-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methylsulfanyl]butanamide Traditional Name: N-(2,6-dimethylphenyl)-4-[[3-(4-methoxyphenyl)isoxazol-5-yl]methylthio]butyramide Formula: C23H26N2O3S MolecularWeight: 410.52914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CCCSCC2=CC(=NO2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CCCSCC2=CC(=NO2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C23H26N2O3S/c1-16-6-4-7-17(2)23(16)24-22(26)8-5-13-29-15-20-14-21(25-28-20)18-9-11-19(27-3)12-10-18/h4,6-7,9-12,14H,5,8,13,15H2,1-3H3,(H,24,26)