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

Systemtic Name: N-[4-[[6-(3-methoxy-4-methylsulfonyl-phenyl)-4,5-dihydro-3H-pyridazin-2-yl]methyl]phenyl]pyridine-3-carboxamide Openeye Name: N-[4-[[6-(3-methoxy-4-methylsulfonyl-phenyl)-4,5-dihydro-3H-pyridazin-2-yl]methyl]phenyl]pyridine-3-carboxamide CAS Name: N-[4-[[6-(3-methoxy-4-methylsulfonylphenyl)-4,5-dihydro-3H-pyridazin-2-yl]methyl]phenyl]-3-pyridinecarboxamide IUPAC Name: N-[4-[[6-(3-methoxy-4-methylsulfonylphenyl)-4,5-dihydro-3H-pyridazin-2-yl]methyl]phenyl]pyridine-3-carboxamide Traditional Name: N-[4-[[6-(4-mesyl-3-methoxy-phenyl)-4,5-dihydro-3H-pyridazin-2-yl]methyl]phenyl]nicotinamide Formula: C25H26N4O4S MolecularWeight: 478.56334

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C25H26N4O4S/c1-33-23-15-19(9-12-24(23)34(2,31)32)22-6-4-14-29(28-22)17-18-7-10-21(11-8-18)27-25(30)20-5-3-13-26-16-20/h3,5,7-13,15-16H,4,6,14,17H2,1-2H3,(H,27,30)