2-methylpropyl-[2-[4-(thiophen-2-ylmethylcarbamoyl)-1,2,3-triazol-1-yl]ethyl]azanium

Systemtic Name: 2-methylpropyl-[2-[4-(thiophen-2-ylmethylcarbamoyl)-1,2,3-triazol-1-yl]ethyl]azanium Openeye Name: isobutyl-[2-[4-(2-thienylmethylcarbamoyl)triazol-1-yl]ethyl]ammonium CAS Name: 2-methylpropyl-[2-[4-[oxo-(thiophen-2-ylmethylamino)methyl]-1-triazolyl]ethyl]ammonium IUPAC Name: 2-methylpropyl-[2-[4-(thiophen-2-ylmethylcarbamoyl)triazol-1-yl]ethyl]azanium Traditional Name: isobutyl-[2-[4-(2-thenylcarbamoyl)triazol-1-yl]ethyl]ammonium Formula: C14H22N5OS+ MolecularWeight: 308.42238

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH2+]CCN1C=C(N=N1)C(=O)NCC2=CC=CS2

Isomeric SMILES

CC(C)C[NH2+]CCN1C=C(N=N1)C(=O)NCC2=CC=CS2

InChI

InChI=1S/C14H21N5OS/c1-11(2)8-15-5-6-19-10-13(17-18-19)14(20)16-9-12-4-3-7-21-12/h3-4,7,10-11,15H,5-6,8-9H2,1-2H3,(H,16,20)/p+1