N-methylsulfonyl-3-(4-phenylmethoxyphenyl)-N-(1,3,5-trimethylpyrazol-4-yl)propanamide

Systemtic Name: N-methylsulfonyl-3-(4-phenylmethoxyphenyl)-N-(1,3,5-trimethylpyrazol-4-yl)propanamide Openeye Name: 3-(4-benzyloxyphenyl)-N-methylsulfonyl-N-(1,3,5-trimethylpyrazol-4-yl)propanamide CAS Name: N-methylsulfonyl-3-(4-phenylmethoxyphenyl)-N-(1,3,5-trimethyl-4-pyrazolyl)propanamide IUPAC Name: N-methylsulfonyl-3-(4-phenylmethoxyphenyl)-N-(1,3,5-trimethylpyrazol-4-yl)propanamide Traditional Name: 3-(4-benzoxyphenyl)-N-mesyl-N-(1,3,5-trimethylpyrazol-4-yl)propionamide Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)N(C(=O)CCC2=CC=C(C=C2)OCC3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

CC1=C(C(=NN1C)C)N(C(=O)CCC2=CC=C(C=C2)OCC3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C23H27N3O4S/c1-17-23(18(2)25(3)24-17)26(31(4,28)29)22(27)15-12-19-10-13-21(14-11-19)30-16-20-8-6-5-7-9-20/h5-11,13-14H,12,15-16H2,1-4H3