2-[4-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]piperazin-1-ium-1-yl]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[4-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]piperazin-1-ium-1-yl]-N-propan-2-yl-ethanamide Openeye Name: N-isopropyl-2-[4-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-[2-[(4-methyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]-1-piperazin-1-iumyl]-N-propan-2-ylacetamide IUPAC Name: 2-[4-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]piperazin-1-ium-1-yl]-N-propan-2-ylacetamide Traditional Name: N-isopropyl-2-[4-[2-[(4-methyl-1,2,4-triazol-3-yl)thio]acetyl]piperazin-1-ium-1-yl]acetamide Formula: C14H25N6O2S+ MolecularWeight: 341.4523

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C[NH+]1CCN(CC1)C(=O)CSC2=NN=CN2C

Isomeric SMILES

CC(C)NC(=O)C[NH+]1CCN(CC1)C(=O)CSC2=NN=CN2C

InChI

InChI=1S/C14H24N6O2S/c1-11(2)16-12(21)8-19-4-6-20(7-5-19)13(22)9-23-14-17-15-10-18(14)3/h10-11H,4-9H2,1-3H3,(H,16,21)/p+1