2-[[(5-bromanylthiophen-2-yl)methyl-methyl-amino]methyl]-8-methyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione

Systemtic Name: 2-[[(5-bromanylthiophen-2-yl)methyl-methyl-amino]methyl]-8-methyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Openeye Name: 2-[[(5-bromo-2-thienyl)methyl-methyl-amino]methyl]-8-methyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione CAS Name: 2-[[(5-bromo-2-thiophenyl)methyl-methylamino]methyl]-8-methyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione IUPAC Name: 2-[[(5-bromothiophen-2-yl)methyl-methylamino]methyl]-8-methyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Traditional Name: 2-[[(5-bromo-2-thienyl)methyl-methyl-amino]methyl]-8-methyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-quinone Formula: C15H22BrN4O2S+ MolecularWeight: 402.32978

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC2(CC1)C(=O)N(C(=O)N2)CN(C)CC3=CC=C(S3)Br

Isomeric SMILES

C[NH+]1CCC2(CC1)C(=O)N(C(=O)N2)CN(C)CC3=CC=C(S3)Br

InChI

InChI=1S/C15H21BrN4O2S/c1-18-7-5-15(6-8-18)13(21)20(14(22)17-15)10-19(2)9-11-3-4-12(16)23-11/h3-4H,5-10H2,1-2H3,(H,17,22)/p+1