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

Systemtic Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-[(1-phenylpyrazol-4-yl)methyl]benzamide Openeye Name: 2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-N-[(1-phenylpyrazol-4-yl)methyl]benzamide CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-N-[(1-phenyl-4-pyrazolyl)methyl]benzamide IUPAC Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-[(1-phenylpyrazol-4-yl)methyl]benzamide Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methylthio]-N-[(1-phenylpyrazol-4-yl)methyl]benzamide Formula: C23H22N4O2S MolecularWeight: 418.51138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSC2=CC=CC=C2C(=O)NCC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=NO1)C)CSC2=CC=CC=C2C(=O)NCC3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H22N4O2S/c1-16-21(17(2)29-26-16)15-30-22-11-7-6-10-20(22)23(28)24-12-18-13-25-27(14-18)19-8-4-3-5-9-19/h3-11,13-14H,12,15H2,1-2H3,(H,24,28)