4-butyl-N-[1-[(3-methoxyphenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]benzenesulfonamide

Systemtic Name: 4-butyl-N-[1-[(3-methoxyphenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]benzenesulfonamide Openeye Name: 4-butyl-N-[1-[(3-methoxyphenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]benzenesulfonamide CAS Name: 4-butyl-N-[1-[(3-methoxyphenyl)methyl]-3,5-dimethyl-4-pyrazolyl]benzenesulfonamide IUPAC Name: 4-butyl-N-[1-[(3-methoxyphenyl)methyl]-3,5-dimethylpyrazol-4-yl]benzenesulfonamide Traditional Name: 4-butyl-N-(1-m-anisyl-3,5-dimethyl-pyrazol-4-yl)benzenesulfonamide Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)S(=O)(=O)NC2=C(N(N=C2C)CC3=CC(=CC=C3)OC)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)S(=O)(=O)NC2=C(N(N=C2C)CC3=CC(=CC=C3)OC)C

InChI

InChI=1S/C23H29N3O3S/c1-5-6-8-19-11-13-22(14-12-19)30(27,28)25-23-17(2)24-26(18(23)3)16-20-9-7-10-21(15-20)29-4/h7,9-15,25H,5-6,8,16H2,1-4H3