1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-4-(3,4,5-triethoxyphenyl)pyrazol-3-amine

Systemtic Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-4-(3,4,5-triethoxyphenyl)pyrazol-3-amine Openeye Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-4-(3,4,5-triethoxyphenyl)pyrazol-3-amine CAS Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-4-(3,4,5-triethoxyphenyl)-3-pyrazolamine IUPAC Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-4-(3,4,5-triethoxyphenyl)pyrazol-3-amine Traditional Name: [1-piazthiol-4-ylsulfonyl-4-(3,4,5-triethoxyphenyl)pyrazol-3-yl]amine Formula: C21H23N5O5S2 MolecularWeight: 489.56782

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C2=CN(N=C2N)S(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C2=CN(N=C2N)S(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C21H23N5O5S2/c1-4-29-16-10-13(11-17(30-5-2)20(16)31-6-3)14-12-26(23-21(14)22)33(27,28)18-9-7-8-15-19(18)25-32-24-15/h7-12H,4-6H2,1-3H3,(H2,22,23)