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

Systemtic Name: dimethyl-[2-[[4-(4-nitrophenyl)-1,3-thiazol-2-yl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: dimethyl-[2-[[4-(4-nitrophenyl)thiazol-2-yl]amino]-2-oxo-ethyl]ammonium CAS Name: dimethyl-[2-[[4-(4-nitrophenyl)-2-thiazolyl]amino]-2-oxoethyl]ammonium IUPAC Name: dimethyl-[2-[[4-(4-nitrophenyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl]azanium Traditional Name: [2-keto-2-[[4-(4-nitrophenyl)thiazol-2-yl]amino]ethyl]-dimethyl-ammonium Formula: C13H15N4O3S+ MolecularWeight: 307.3482

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC(=O)NC1=NC(=CS1)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C[NH+](C)CC(=O)NC1=NC(=CS1)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H14N4O3S/c1-16(2)7-12(18)15-13-14-11(8-21-13)9-3-5-10(6-4-9)17(19)20/h3-6,8H,7H2,1-2H3,(H,14,15,18)/p+1