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

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-methyl-[2-oxidanylidene-2-[[2-(phenylcarbonyl)phenyl]amino]ethyl]azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-[2-(2-benzoylanilino)-2-oxo-ethyl]-methyl-ammonium CAS Name: 1,3-benzothiazol-2-ylmethyl-[2-(2-benzoylanilino)-2-oxoethyl]-methylammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-[2-(2-benzoylanilino)-2-oxoethyl]-methylazanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-[2-(2-benzoylanilino)-2-keto-ethyl]-methyl-ammonium Formula: C24H22N3O2S+ MolecularWeight: 416.51538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H21N3O2S/c1-27(16-23-26-20-13-7-8-14-21(20)30-23)15-22(28)25-19-12-6-5-11-18(19)24(29)17-9-3-2-4-10-17/h2-14H,15-16H2,1H3,(H,25,28)/p+1