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

Systemtic Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-[4-(2-methylpropanoylamino)phenyl]benzamide Openeye Name: 2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-N-[4-(2-methylpropanoylamino)phenyl]benzamide CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-N-[4-[(2-methyl-1-oxopropyl)amino]phenyl]benzamide IUPAC Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-[4-(2-methylpropanoylamino)phenyl]benzamide Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methylthio]-N-[4-(isobutyrylamino)phenyl]benzamide Formula: C23H25N3O3S MolecularWeight: 423.5279

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)NC(=O)C(C)C

Isomeric SMILES

CC1=C(C(=NO1)C)CSC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)NC(=O)C(C)C

InChI

InChI=1S/C23H25N3O3S/c1-14(2)22(27)24-17-9-11-18(12-10-17)25-23(28)19-7-5-6-8-21(19)30-13-20-15(3)26-29-16(20)4/h5-12,14H,13H2,1-4H3,(H,24,27)(H,25,28)