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

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-[(1S)-2-(dimethylamino)-2-oxidanylidene-1-phenyl-ethyl]-methyl-azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-[(1S)-2-(dimethylamino)-2-oxo-1-phenyl-ethyl]-methyl-ammonium CAS Name: 1,3-benzothiazol-2-ylmethyl-[(1S)-2-(dimethylamino)-2-oxo-1-phenylethyl]-methylammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-[(1S)-2-(dimethylamino)-2-oxo-1-phenylethyl]-methylazanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-[(1S)-2-(dimethylamino)-2-keto-1-phenyl-ethyl]-methyl-ammonium Formula: C19H22N3OS+ MolecularWeight: 340.46248

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=NC2=CC=CC=C2S1)C(C3=CC=CC=C3)C(=O)N(C)C

Isomeric SMILES

C[NH+](CC1=NC2=CC=CC=C2S1)[C@@H](C3=CC=CC=C3)C(=O)N(C)C

InChI

InChI=1S/C19H21N3OS/c1-21(2)19(23)18(14-9-5-4-6-10-14)22(3)13-17-20-15-11-7-8-12-16(15)24-17/h4-12,18H,13H2,1-3H3/p+1/t18-/m0/s1