2-[(4-azanyl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(4-methylsulfonylpiperazin-1-yl)phenyl]ethanamide

Systemtic Name: 2-[(4-azanyl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(4-methylsulfonylpiperazin-1-yl)phenyl]ethanamide Openeye Name: 2-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(4-methylsulfonylpiperazin-1-yl)phenyl]acetamide CAS Name: 2-[(4-amino-1,2,4-triazol-3-yl)thio]-N-[2-(4-methylsulfonyl-1-piperazinyl)phenyl]acetamide IUPAC Name: 2-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(4-methylsulfonylpiperazin-1-yl)phenyl]acetamide Traditional Name: 2-[(4-amino-1,2,4-triazol-3-yl)thio]-N-[2-(4-mesylpiperazino)phenyl]acetamide Formula: C15H21N7O3S2 MolecularWeight: 411.50234

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C2=CC=CC=C2NC(=O)CSC3=NN=CN3N

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C2=CC=CC=C2NC(=O)CSC3=NN=CN3N

InChI

InChI=1S/C15H21N7O3S2/c1-27(24,25)21-8-6-20(7-9-21)13-5-3-2-4-12(13)18-14(23)10-26-15-19-17-11-22(15)16/h2-5,11H,6-10,16H2,1H3,(H,18,23)