methyl 5-[[4-[(3-methylbutanoylamino)methyl]phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate

Systemtic Name: methyl 5-[[4-[(3-methylbutanoylamino)methyl]phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate Openeye Name: methyl 5-[[4-[(3-methylbutanoylamino)methyl]phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate CAS Name: 5-[[[4-[[(3-methyl-1-oxobutyl)amino]methyl]phenyl]sulfonylamino]-oxomethyl]-2-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-[[4-[(3-methylbutanoylamino)methyl]phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate Traditional Name: 5-[[4-[(isovalerylamino)methyl]phenyl]sulfonylcarbamoyl]picolinic acid methyl ester Formula: C20H23N3O6S MolecularWeight: 433.47812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NCC1=CC=C(C=C1)S(=O)(=O)NC(=O)C2=CN=C(C=C2)C(=O)OC

Isomeric SMILES

CC(C)CC(=O)NCC1=CC=C(C=C1)S(=O)(=O)NC(=O)C2=CN=C(C=C2)C(=O)OC

InChI

InChI=1S/C20H23N3O6S/c1-13(2)10-18(24)22-11-14-4-7-16(8-5-14)30(27,28)23-19(25)15-6-9-17(21-12-15)20(26)29-3/h4-9,12-13H,10-11H2,1-3H3,(H,22,24)(H,23,25)