1,3-benzothiazol-2-ylmethyl-methyl-[(2R)-1-oxidanylidene-1-[(2-phenylphenyl)amino]propan-2-yl]azanium

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-methyl-[(2R)-1-oxidanylidene-1-[(2-phenylphenyl)amino]propan-2-yl]azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-methyl-[(1R)-1-methyl-2-oxo-2-(2-phenylanilino)ethyl]ammonium CAS Name: 1,3-benzothiazol-2-ylmethyl-methyl-[(2R)-1-oxo-1-(2-phenylanilino)propan-2-yl]ammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-methyl-[(2R)-1-oxo-1-(2-phenylanilino)propan-2-yl]azanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-[(1R)-2-keto-1-methyl-2-(2-phenylanilino)ethyl]-methyl-ammonium Formula: C24H24N3OS+ MolecularWeight: 402.53186

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C2=CC=CC=C2)[NH+](C)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1C2=CC=CC=C2)[NH+](C)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C24H23N3OS/c1-17(27(2)16-23-25-21-14-8-9-15-22(21)29-23)24(28)26-20-13-7-6-12-19(20)18-10-4-3-5-11-18/h3-15,17H,16H2,1-2H3,(H,26,28)/p+1/t17-/m1/s1