2-[1,3-benzothiazol-2-yl-[(5-methyl-1,2-oxazol-3-yl)carbonyl]amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[1,3-benzothiazol-2-yl-[(5-methyl-1,2-oxazol-3-yl)carbonyl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[1,3-benzothiazol-2-yl-(5-methylisoxazole-3-carbonyl)amino]ethyl-dimethyl-ammonium CAS Name: 2-[1,3-benzothiazol-2-yl-[(5-methyl-3-isoxazolyl)-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[1,3-benzothiazol-2-yl-(5-methyl-1,2-oxazole-3-carbonyl)amino]ethyl-dimethylazanium Traditional Name: 2-[1,3-benzothiazol-2-yl-(5-methylisoxazole-3-carbonyl)amino]ethyl-dimethyl-ammonium Formula: C16H19N4O2S+ MolecularWeight: 331.41266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)C(=O)N(CC[NH+](C)C)C2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=CC(=NO1)C(=O)N(CC[NH+](C)C)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H18N4O2S/c1-11-10-13(18-22-11)15(21)20(9-8-19(2)3)16-17-12-6-4-5-7-14(12)23-16/h4-7,10H,8-9H2,1-3H3/p+1