N,N-dimethyl-4-[2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]ethanoylamino]benzamide

Systemtic Name: N,N-dimethyl-4-[2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]ethanoylamino]benzamide Openeye Name: N,N-dimethyl-4-[[2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]acetyl]amino]benzamide CAS Name: N,N-dimethyl-4-[[1-oxo-2-[[4-(1-pyrazolyl)phenyl]methylthio]ethyl]amino]benzamide IUPAC Name: N,N-dimethyl-4-[[2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]acetyl]amino]benzamide Traditional Name: N,N-dimethyl-4-[[2-[(4-pyrazol-1-ylbenzyl)thio]acetyl]amino]benzamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC=C(C=C1)NC(=O)CSCC2=CC=C(C=C2)N3C=CC=N3

Isomeric SMILES

CN(C)C(=O)C1=CC=C(C=C1)NC(=O)CSCC2=CC=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C21H22N4O2S/c1-24(2)21(27)17-6-8-18(9-7-17)23-20(26)15-28-14-16-4-10-19(11-5-16)25-13-3-12-22-25/h3-13H,14-15H2,1-2H3,(H,23,26)