N-[(1,3-diphenylpyrazol-4-yl)methyl]-2,3,4,5,6-pentamethyl-benzenesulfonamide

Systemtic Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-2,3,4,5,6-pentamethyl-benzenesulfonamide Openeye Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-2,3,4,5,6-pentamethyl-benzenesulfonamide CAS Name: N-[(1,3-diphenyl-4-pyrazolyl)methyl]-2,3,4,5,6-pentamethylbenzenesulfonamide IUPAC Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-2,3,4,5,6-pentamethylbenzenesulfonamide Traditional Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-2,3,4,5,6-pentamethyl-benzenesulfonamide Formula: C27H29N3O2S MolecularWeight: 459.60306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C)C)S(=O)(=O)NCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)C)C

Isomeric SMILES

CC1=C(C(=C(C(=C1C)C)S(=O)(=O)NCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)C)C

InChI

InChI=1S/C27H29N3O2S/c1-18-19(2)21(4)27(22(5)20(18)3)33(31,32)28-16-24-17-30(25-14-10-7-11-15-25)29-26(24)23-12-8-6-9-13-23/h6-15,17,28H,16H2,1-5H3