2-(4-butanoylphenyl)-N-(3-methoxy-5-methyl-pyrazin-2-yl)pyridine-3-sulfonamide

Systemtic Name: 2-(4-butanoylphenyl)-N-(3-methoxy-5-methyl-pyrazin-2-yl)pyridine-3-sulfonamide Openeye Name: 2-(4-butanoylphenyl)-N-(3-methoxy-5-methyl-pyrazin-2-yl)pyridine-3-sulfonamide CAS Name: N-(3-methoxy-5-methyl-2-pyrazinyl)-2-[4-(1-oxobutyl)phenyl]-3-pyridinesulfonamide IUPAC Name: 2-(4-butanoylphenyl)-N-(3-methoxy-5-methylpyrazin-2-yl)pyridine-3-sulfonamide Traditional Name: 2-(4-butyrylphenyl)-N-(3-methoxy-5-methyl-pyrazin-2-yl)pyridine-3-sulfonamide Formula: C21H22N4O4S MolecularWeight: 426.48878

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CC=C(C=C1)C2=C(C=CC=N2)S(=O)(=O)NC3=NC=C(N=C3OC)C

Isomeric SMILES

CCCC(=O)C1=CC=C(C=C1)C2=C(C=CC=N2)S(=O)(=O)NC3=NC=C(N=C3OC)C

InChI

InChI=1S/C21H22N4O4S/c1-4-6-17(26)15-8-10-16(11-9-15)19-18(7-5-12-22-19)30(27,28)25-20-21(29-3)24-14(2)13-23-20/h5,7-13H,4,6H2,1-3H3,(H,23,25)