(4-methyl-1,2,3-thiadiazol-5-yl)-[4-(thiophen-2-ylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: (4-methyl-1,2,3-thiadiazol-5-yl)-[4-(thiophen-2-ylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: (4-methylthiadiazol-5-yl)-[4-(2-thienylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: (4-methyl-5-thiadiazolyl)-[4-(thiophen-2-ylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: (4-methylthiadiazol-5-yl)-[4-(thiophen-2-ylmethyl)piperazin-4-ium-1-yl]methanone Traditional Name: (4-methylthiadiazol-5-yl)-[4-(2-thenyl)piperazin-4-ium-1-yl]methanone Formula: C13H17N4OS2+ MolecularWeight: 309.43028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SN=N1)C(=O)N2CC[NH+](CC2)CC3=CC=CS3

Isomeric SMILES

CC1=C(SN=N1)C(=O)N2CC[NH+](CC2)CC3=CC=CS3

InChI

InChI=1S/C13H16N4OS2/c1-10-12(20-15-14-10)13(18)17-6-4-16(5-7-17)9-11-3-2-8-19-11/h2-3,8H,4-7,9H2,1H3/p+1