N-[4-[2-[6-(3-methoxy-4-methylsulfonyl-phenyl)-4,5-dihydro-3H-pyridazin-2-yl]-2-oxidanylidene-ethyl]phenyl]pyridine-3-carboxamide

Systemtic Name: N-[4-[2-[6-(3-methoxy-4-methylsulfonyl-phenyl)-4,5-dihydro-3H-pyridazin-2-yl]-2-oxidanylidene-ethyl]phenyl]pyridine-3-carboxamide Openeye Name: N-[4-[2-[6-(3-methoxy-4-methylsulfonyl-phenyl)-4,5-dihydro-3H-pyridazin-2-yl]-2-oxo-ethyl]phenyl]pyridine-3-carboxamide CAS Name: N-[4-[2-[6-(3-methoxy-4-methylsulfonylphenyl)-4,5-dihydro-3H-pyridazin-2-yl]-2-oxoethyl]phenyl]-3-pyridinecarboxamide IUPAC Name: N-[4-[2-[6-(3-methoxy-4-methylsulfonylphenyl)-4,5-dihydro-3H-pyridazin-2-yl]-2-oxoethyl]phenyl]pyridine-3-carboxamide Traditional Name: N-[4-[2-keto-2-[6-(4-mesyl-3-methoxy-phenyl)-4,5-dihydro-3H-pyridazin-2-yl]ethyl]phenyl]nicotinamide Formula: C26H26N4O5S MolecularWeight: 506.57344

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2=NN(CCC2)C(=O)CC3=CC=C(C=C3)NC(=O)C4=CN=CC=C4)S(=O)(=O)C

Isomeric SMILES

COC1=C(C=CC(=C1)C2=NN(CCC2)C(=O)CC3=CC=C(C=C3)NC(=O)C4=CN=CC=C4)S(=O)(=O)C

InChI

InChI=1S/C26H26N4O5S/c1-35-23-16-19(9-12-24(23)36(2,33)34)22-6-4-14-30(29-22)25(31)15-18-7-10-21(11-8-18)28-26(32)20-5-3-13-27-17-20/h3,5,7-13,16-17H,4,6,14-15H2,1-2H3,(H,28,32)