3-[2-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methylsulfanyl]ethanoylamino]-N-methyl-benzamide

Systemtic Name: 3-[2-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methylsulfanyl]ethanoylamino]-N-methyl-benzamide Openeye Name: 3-[[2-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methylsulfanyl]acetyl]amino]-N-methyl-benzamide CAS Name: 3-[[2-[[3-(4-methoxyphenyl)-1-phenyl-4-pyrazolyl]methylthio]-1-oxoethyl]amino]-N-methylbenzamide IUPAC Name: 3-[[2-[[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]methylsulfanyl]acetyl]amino]-N-methylbenzamide Traditional Name: 3-[[2-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methylthio]acetyl]amino]-N-methyl-benzamide Formula: C27H26N4O3S MolecularWeight: 486.58534

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC(=CC=C1)NC(=O)CSCC2=CN(N=C2C3=CC=C(C=C3)OC)C4=CC=CC=C4

Isomeric SMILES

CNC(=O)C1=CC(=CC=C1)NC(=O)CSCC2=CN(N=C2C3=CC=C(C=C3)OC)C4=CC=CC=C4

InChI

InChI=1S/C27H26N4O3S/c1-28-27(33)20-7-6-8-22(15-20)29-25(32)18-35-17-21-16-31(23-9-4-3-5-10-23)30-26(21)19-11-13-24(34-2)14-12-19/h3-16H,17-18H2,1-2H3,(H,28,33)(H,29,32)