1,3-benzothiazol-2-ylmethyl-methyl-[2-oxidanylidene-2-[[2-(phenylcarbamoyl)phenyl]amino]ethyl]azanium

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-methyl-[2-oxidanylidene-2-[[2-(phenylcarbamoyl)phenyl]amino]ethyl]azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-methyl-[2-oxo-2-[2-(phenylcarbamoyl)anilino]ethyl]ammonium CAS Name: [2-[2-[anilino(oxo)methyl]anilino]-2-oxoethyl]-(1,3-benzothiazol-2-ylmethyl)-methylammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-methyl-[2-oxo-2-[2-(phenylcarbamoyl)anilino]ethyl]azanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-[2-keto-2-[2-(phenylcarbamoyl)anilino]ethyl]-methyl-ammonium Formula: C24H23N4O2S+ MolecularWeight: 431.53002

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=NC2=CC=CC=C2S1)CC(=O)NC3=CC=CC=C3C(=O)NC4=CC=CC=C4

Isomeric SMILES

C[NH+](CC1=NC2=CC=CC=C2S1)CC(=O)NC3=CC=CC=C3C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C24H22N4O2S/c1-28(16-23-27-20-13-7-8-14-21(20)31-23)15-22(29)26-19-12-6-5-11-18(19)24(30)25-17-9-3-2-4-10-17/h2-14H,15-16H2,1H3,(H,25,30)(H,26,29)/p+1