1-(phenylsulfonyl)-4-(3,4,5-triethoxyphenyl)pyrazol-3-amine

Systemtic Name: 1-(phenylsulfonyl)-4-(3,4,5-triethoxyphenyl)pyrazol-3-amine Openeye Name: 1-(benzenesulfonyl)-4-(3,4,5-triethoxyphenyl)pyrazol-3-amine CAS Name: 1-(benzenesulfonyl)-4-(3,4,5-triethoxyphenyl)-3-pyrazolamine IUPAC Name: 1-(benzenesulfonyl)-4-(3,4,5-triethoxyphenyl)pyrazol-3-amine Traditional Name: [1-besyl-4-(3,4,5-triethoxyphenyl)pyrazol-3-yl]amine Formula: C21H25N3O5S MolecularWeight: 431.5053

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C2=CN(N=C2N)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C2=CN(N=C2N)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H25N3O5S/c1-4-27-18-12-15(13-19(28-5-2)20(18)29-6-3)17-14-24(23-21(17)22)30(25,26)16-10-8-7-9-11-16/h7-14H,4-6H2,1-3H3,(H2,22,23)