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

Systemtic Name: (4-methyl-1,2,3-thiadiazol-5-yl)-[4-(thiophen-3-ylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: (4-methylthiadiazol-5-yl)-[4-(3-thienylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: (4-methyl-5-thiadiazolyl)-[4-(3-thiophenylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: (4-methylthiadiazol-5-yl)-[4-(thiophen-3-ylmethyl)piperazin-4-ium-1-yl]methanone Traditional Name: (4-methylthiadiazol-5-yl)-[4-(3-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=CSC=C3

Isomeric SMILES

CC1=C(SN=N1)C(=O)N2CC[NH+](CC2)CC3=CSC=C3

InChI

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