N-[(1,3-diphenylpyrazol-4-yl)methyl]-N-methyl-3-(4-methylphenyl)sulfonyl-propanamide

Systemtic Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-N-methyl-3-(4-methylphenyl)sulfonyl-propanamide Openeye Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-N-methyl-3-(p-tolylsulfonyl)propanamide CAS Name: N-[(1,3-diphenyl-4-pyrazolyl)methyl]-N-methyl-3-(4-methylphenyl)sulfonylpropanamide IUPAC Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-N-methyl-3-(4-methylphenyl)sulfonylpropanamide Traditional Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-N-methyl-3-tosyl-propionamide Formula: C27H27N3O3S MolecularWeight: 473.58658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)N(C)CC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)N(C)CC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H27N3O3S/c1-21-13-15-25(16-14-21)34(32,33)18-17-26(31)29(2)19-23-20-30(24-11-7-4-8-12-24)28-27(23)22-9-5-3-6-10-22/h3-16,20H,17-19H2,1-2H3