2-methoxy-N-[4-methylsulfanyl-1-oxidanylidene-1-[[2-(pyrazol-1-ylmethyl)phenyl]methylamino]butan-2-yl]benzamide

Systemtic Name: 2-methoxy-N-[4-methylsulfanyl-1-oxidanylidene-1-[[2-(pyrazol-1-ylmethyl)phenyl]methylamino]butan-2-yl]benzamide Openeye Name: 2-methoxy-N-[3-methylsulfanyl-1-[[2-(pyrazol-1-ylmethyl)phenyl]methylcarbamoyl]propyl]benzamide CAS Name: 2-methoxy-N-[4-(methylthio)-1-oxo-1-[[2-(1-pyrazolylmethyl)phenyl]methylamino]butan-2-yl]benzamide IUPAC Name: 2-methoxy-N-[4-methylsulfanyl-1-oxo-1-[[2-(pyrazol-1-ylmethyl)phenyl]methylamino]butan-2-yl]benzamide Traditional Name: 2-methoxy-N-[3-(methylthio)-1-[[2-(pyrazol-1-ylmethyl)benzyl]carbamoyl]propyl]benzamide Formula: C24H28N4O3S MolecularWeight: 452.56912

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC(CCSC)C(=O)NCC2=CC=CC=C2CN3C=CC=N3

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC(CCSC)C(=O)NCC2=CC=CC=C2CN3C=CC=N3

InChI

InChI=1S/C24H28N4O3S/c1-31-22-11-6-5-10-20(22)23(29)27-21(12-15-32-2)24(30)25-16-18-8-3-4-9-19(18)17-28-14-7-13-26-28/h3-11,13-14,21H,12,15-17H2,1-2H3,(H,25,30)(H,27,29)