N-[4-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]ethanoylamino]-2-methyl-phenyl]-3-methylsulfonyl-benzamide

Systemtic Name: N-[4-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]ethanoylamino]-2-methyl-phenyl]-3-methylsulfonyl-benzamide Openeye Name: N-[4-[[2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]acetyl]amino]-2-methyl-phenyl]-3-methylsulfonyl-benzamide CAS Name: N-[4-[[2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-1-oxoethyl]amino]-2-methylphenyl]-3-methylsulfonylbenzamide IUPAC Name: N-[4-[[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]acetyl]amino]-2-methylphenyl]-3-methylsulfonylbenzamide Traditional Name: N-[4-[[2-[(3,5-dimethylisoxazol-4-yl)methylthio]acetyl]amino]-2-methyl-phenyl]-3-mesyl-benzamide Formula: C23H25N3O5S2 MolecularWeight: 487.5917

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CSCC2=C(ON=C2C)C)NC(=O)C3=CC(=CC=C3)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CSCC2=C(ON=C2C)C)NC(=O)C3=CC(=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C23H25N3O5S2/c1-14-10-18(24-22(27)13-32-12-20-15(2)26-31-16(20)3)8-9-21(14)25-23(28)17-6-5-7-19(11-17)33(4,29)30/h5-11H,12-13H2,1-4H3,(H,24,27)(H,25,28)