3-[butanoyl-[2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[butanoyl-[2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]amino]propyl-dimethyl-azanium Openeye Name: 3-[butanoyl-[2-[(4,5-dimethylthiazol-2-yl)amino]-2-oxo-ethyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[2-[(4,5-dimethyl-2-thiazolyl)amino]-2-oxoethyl]-(1-oxobutyl)amino]propyl-dimethylammonium IUPAC Name: 3-[butanoyl-[2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]amino]propyl-dimethylazanium Traditional Name: 3-[butyryl-[2-[(4,5-dimethylthiazol-2-yl)amino]-2-keto-ethyl]amino]propyl-dimethyl-ammonium Formula: C16H29N4O2S+ MolecularWeight: 341.49206

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N(CCC[NH+](C)C)CC(=O)NC1=NC(=C(S1)C)C

Isomeric SMILES

CCCC(=O)N(CCC[NH+](C)C)CC(=O)NC1=NC(=C(S1)C)C

InChI

InChI=1S/C16H28N4O2S/c1-6-8-15(22)20(10-7-9-19(4)5)11-14(21)18-16-17-12(2)13(3)23-16/h6-11H2,1-5H3,(H,17,18,21)/p+1