N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-(2-pyridin-4-ylsulfanylethanoylamino)benzamide

Systemtic Name: N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-(2-pyridin-4-ylsulfanylethanoylamino)benzamide Openeye Name: N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-3-[[2-(4-pyridylsulfanyl)acetyl]amino]benzamide CAS Name: N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-3-[[1-oxo-2-(pyridin-4-ylthio)ethyl]amino]benzamide IUPAC Name: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3-[(2-pyridin-4-ylsulfanylacetyl)amino]benzamide Traditional Name: N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-3-[[2-(4-pyridylthio)acetyl]amino]benzamide Formula: C25H23N5O3S MolecularWeight: 473.54682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=CC(=CC=C3)NC(=O)CSC4=CC=NC=C4

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=CC(=CC=C3)NC(=O)CSC4=CC=NC=C4

InChI

InChI=1S/C25H23N5O3S/c1-17-23(25(33)30(29(17)2)20-9-4-3-5-10-20)28-24(32)18-7-6-8-19(15-18)27-22(31)16-34-21-11-13-26-14-12-21/h3-15H,16H2,1-2H3,(H,27,31)(H,28,32)