2-[(4-methoxy-1,3-benzothiazol-2-yl)-[(5-methyl-1,2-oxazol-3-yl)carbonyl]amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(4-methoxy-1,3-benzothiazol-2-yl)-[(5-methyl-1,2-oxazol-3-yl)carbonyl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[(4-methoxy-1,3-benzothiazol-2-yl)-(5-methylisoxazole-3-carbonyl)amino]ethyl-dimethyl-ammonium CAS Name: 2-[(4-methoxy-1,3-benzothiazol-2-yl)-[(5-methyl-3-isoxazolyl)-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(4-methoxy-1,3-benzothiazol-2-yl)-(5-methyl-1,2-oxazole-3-carbonyl)amino]ethyl-dimethylazanium Traditional Name: 2-[(4-methoxy-1,3-benzothiazol-2-yl)-(5-methylisoxazole-3-carbonyl)amino]ethyl-dimethyl-ammonium Formula: C17H21N4O3S+ MolecularWeight: 361.43864

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N4O3S/c1-11-10-12(19-24-11)16(22)21(9-8-20(2)3)17-18-15-13(23-4)6-5-7-14(15)25-17/h5-7,10H,8-9H2,1-4H3/p+1