1-[(4-methylpiperidin-1-ium-1-yl)methyl]-4-thiophen-2-yl-1,2,3,4-tetrazol-5-one

Systemtic Name: 1-[(4-methylpiperidin-1-ium-1-yl)methyl]-4-thiophen-2-yl-1,2,3,4-tetrazol-5-one Openeye Name: 1-[(4-methylpiperidin-1-ium-1-yl)methyl]-4-(2-thienyl)tetrazol-5-one CAS Name: 1-[(4-methyl-1-piperidin-1-iumyl)methyl]-4-thiophen-2-yl-5-tetrazolone IUPAC Name: 1-[(4-methylpiperidin-1-ium-1-yl)methyl]-4-thiophen-2-yltetrazol-5-one Traditional Name: 1-[(4-methylpiperidin-1-ium-1-yl)methyl]-4-(2-thienyl)tetrazol-5-one Formula: C12H18N5OS+ MolecularWeight: 280.36922

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CN2C(=O)N(N=N2)C3=CC=CS3

Isomeric SMILES

CC1CC[NH+](CC1)CN2C(=O)N(N=N2)C3=CC=CS3

InChI

InChI=1S/C12H17N5OS/c1-10-4-6-15(7-5-10)9-16-12(18)17(14-13-16)11-3-2-8-19-11/h2-3,8,10H,4-7,9H2,1H3/p+1