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

Systemtic Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-[4-(methylcarbamoylamino)phenyl]benzamide Openeye Name: 2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-N-[4-(methylcarbamoylamino)phenyl]benzamide CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-N-[4-(methylcarbamoylamino)phenyl]benzamide IUPAC Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-[4-(methylcarbamoylamino)phenyl]benzamide Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methylthio]-N-[4-(methylcarbamoylamino)phenyl]benzamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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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)NC

Isomeric SMILES

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

InChI

InChI=1S/C21H22N4O3S/c1-13-18(14(2)28-25-13)12-29-19-7-5-4-6-17(19)20(26)23-15-8-10-16(11-9-15)24-21(27)22-3/h4-11H,12H2,1-3H3,(H,23,26)(H2,22,24,27)