4-[1,2-bis(phenylsulfonyl)ethyl]-4H-pyrazole-3,5-diamine

Systemtic Name: 4-[1,2-bis(phenylsulfonyl)ethyl]-4H-pyrazole-3,5-diamine Openeye Name: 4-[1,2-bis(benzenesulfonyl)ethyl]-4H-pyrazole-3,5-diamine CAS Name: 4-[1,2-bis(benzenesulfonyl)ethyl]-4H-pyrazole-3,5-diamine IUPAC Name: 4-[1,2-bis(benzenesulfonyl)ethyl]-4H-pyrazole-3,5-diamine Traditional Name: [5-amino-4-(1,2-dibesylethyl)-4H-pyrazol-3-yl]amine Formula: C17H18N4O4S2 MolecularWeight: 406.47922

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N4O4S2/c18-16-15(17(19)21-20-16)14(27(24,25)13-9-5-2-6-10-13)11-26(22,23)12-7-3-1-4-8-12/h1-10,14-15H,11H2,(H2,18,20)(H2,19,21)