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

Systemtic Name: 2-methoxy-N-[4-methylsulfanyl-1-oxidanylidene-1-[(1-phenylpyrazol-4-yl)methylamino]butan-2-yl]benzamide Openeye Name: 2-methoxy-N-[3-methylsulfanyl-1-[(1-phenylpyrazol-4-yl)methylcarbamoyl]propyl]benzamide CAS Name: 2-methoxy-N-[4-(methylthio)-1-oxo-1-[(1-phenyl-4-pyrazolyl)methylamino]butan-2-yl]benzamide IUPAC Name: 2-methoxy-N-[4-methylsulfanyl-1-oxo-1-[(1-phenylpyrazol-4-yl)methylamino]butan-2-yl]benzamide Traditional Name: 2-methoxy-N-[3-(methylthio)-1-[(1-phenylpyrazol-4-yl)methylcarbamoyl]propyl]benzamide Formula: C23H26N4O3S MolecularWeight: 438.54254

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC(CCSC)C(=O)NCC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC(CCSC)C(=O)NCC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C23H26N4O3S/c1-30-21-11-7-6-10-19(21)22(28)26-20(12-13-31-2)23(29)24-14-17-15-25-27(16-17)18-8-4-3-5-9-18/h3-11,15-16,20H,12-14H2,1-2H3,(H,24,29)(H,26,28)