(1S)-1-phenyl-2-(2-phenylazanyl-1,3-benzothiazol-3-ium-3-yl)ethanol

Systemtic Name: (1S)-1-phenyl-2-(2-phenylazanyl-1,3-benzothiazol-3-ium-3-yl)ethanol Openeye Name: (1S)-2-(2-anilino-1,3-benzothiazol-3-ium-3-yl)-1-phenyl-ethanol CAS Name: (1S)-2-(2-anilino-1,3-benzothiazol-3-ium-3-yl)-1-phenylethanol IUPAC Name: (1S)-2-(2-anilino-1,3-benzothiazol-3-ium-3-yl)-1-phenylethanol Traditional Name: (1S)-2-(2-anilino-1,3-benzothiazol-3-ium-3-yl)-1-phenyl-ethanol Formula: C21H19N2OS+ MolecularWeight: 347.45336

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C[N+]2=C(SC3=CC=CC=C32)NC4=CC=CC=C4)O

Isomeric SMILES

C1=CC=C(C=C1)[C@@H](C[N+]2=C(SC3=CC=CC=C32)NC4=CC=CC=C4)O

InChI

InChI=1S/C21H18N2OS/c24-19(16-9-3-1-4-10-16)15-23-18-13-7-8-14-20(18)25-21(23)22-17-11-5-2-6-12-17/h1-14,19,24H,15H2/p+1/t19-/m1/s1