N-methylsulfonyl-4-oxidanylidene-4-(4-pentoxyphenyl)-N-(1,3,5-trimethylpyrazol-4-yl)butanamide

Systemtic Name: N-methylsulfonyl-4-oxidanylidene-4-(4-pentoxyphenyl)-N-(1,3,5-trimethylpyrazol-4-yl)butanamide Openeye Name: N-methylsulfonyl-4-oxo-4-(4-pentoxyphenyl)-N-(1,3,5-trimethylpyrazol-4-yl)butanamide CAS Name: N-methylsulfonyl-4-oxo-4-(4-pentoxyphenyl)-N-(1,3,5-trimethyl-4-pyrazolyl)butanamide IUPAC Name: N-methylsulfonyl-4-oxo-4-(4-pentoxyphenyl)-N-(1,3,5-trimethylpyrazol-4-yl)butanamide Traditional Name: 4-(4-amoxyphenyl)-4-keto-N-mesyl-N-(1,3,5-trimethylpyrazol-4-yl)butyramide Formula: C22H31N3O5S MolecularWeight: 449.56364

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)CCC(=O)N(C2=C(N(N=C2C)C)C)S(=O)(=O)C

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)CCC(=O)N(C2=C(N(N=C2C)C)C)S(=O)(=O)C

InChI

InChI=1S/C22H31N3O5S/c1-6-7-8-15-30-19-11-9-18(10-12-19)20(26)13-14-21(27)25(31(5,28)29)22-16(2)23-24(4)17(22)3/h9-12H,6-8,13-15H2,1-5H3