1,3-benzothiazol-2-ylmethyl-methyl-(2-oxidanylidene-2-phenylazanyl-ethyl)azanium

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-methyl-(2-oxidanylidene-2-phenylazanyl-ethyl)azanium Openeye Name: (2-anilino-2-oxo-ethyl)-(1,3-benzothiazol-2-ylmethyl)-methyl-ammonium CAS Name: (2-anilino-2-oxoethyl)-(1,3-benzothiazol-2-ylmethyl)-methylammonium IUPAC Name: (2-anilino-2-oxoethyl)-(1,3-benzothiazol-2-ylmethyl)-methylazanium Traditional Name: (2-anilino-2-keto-ethyl)-(1,3-benzothiazol-2-ylmethyl)-methyl-ammonium Formula: C17H18N3OS+ MolecularWeight: 312.40932

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=NC2=CC=CC=C2S1)CC(=O)NC3=CC=CC=C3

Isomeric SMILES

C[NH+](CC1=NC2=CC=CC=C2S1)CC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C17H17N3OS/c1-20(11-16(21)18-13-7-3-2-4-8-13)12-17-19-14-9-5-6-10-15(14)22-17/h2-10H,11-12H2,1H3,(H,18,21)/p+1