2-[2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]ethyl-di(propan-2-yl)azanium

Systemtic Name: 2-[2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]ethyl-di(propan-2-yl)azanium Openeye Name: 2-[[2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]ethyl-diisopropyl-ammonium CAS Name: 2-[[2-[(4-cyclopropyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-[[2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]ethyl-di(propan-2-yl)azanium Traditional Name: 2-[[2-[(4-cyclopropyl-1,2,4-triazol-3-yl)thio]acetyl]amino]ethyl-diisopropyl-ammonium Formula: C15H28N5OS+ MolecularWeight: 326.48072

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CCNC(=O)CSC1=NN=CN1C2CC2)C(C)C

Isomeric SMILES

CC(C)[NH+](CCNC(=O)CSC1=NN=CN1C2CC2)C(C)C

InChI

InChI=1S/C15H27N5OS/c1-11(2)19(12(3)4)8-7-16-14(21)9-22-15-18-17-10-20(15)13-5-6-13/h10-13H,5-9H2,1-4H3,(H,16,21)/p+1