4-[1,2-bis-(4-methylphenyl)sulfonylethyl]-4H-pyrazole-3,5-diamine

Systemtic Name: 4-[1,2-bis-(4-methylphenyl)sulfonylethyl]-4H-pyrazole-3,5-diamine Openeye Name: 4-[1,2-bis(p-tolylsulfonyl)ethyl]-4H-pyrazole-3,5-diamine CAS Name: 4-[1,2-bis-(4-methylphenyl)sulfonylethyl]-4H-pyrazole-3,5-diamine IUPAC Name: 4-[1,2-bis-(4-methylphenyl)sulfonylethyl]-4H-pyrazole-3,5-diamine Traditional Name: [5-amino-4-(1,2-ditosylethyl)-4H-pyrazol-3-yl]amine Formula: C19H22N4O4S2 MolecularWeight: 434.53238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC(C2C(=NN=C2N)N)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC(C2C(=NN=C2N)N)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C19H22N4O4S2/c1-12-3-7-14(8-4-12)28(24,25)11-16(17-18(20)22-23-19(17)21)29(26,27)15-9-5-13(2)6-10-15/h3-10,16-17H,11H2,1-2H3,(H2,20,22)(H2,21,23)