(3S)-5,6-dimethoxy-3-phenyl-2-(phenylmethyl)-3H-1,2-benzothiazole 1-oxide

Systemtic Name: (3S)-5,6-dimethoxy-3-phenyl-2-(phenylmethyl)-3H-1,2-benzothiazole 1-oxide Openeye Name: (3S)-2-benzyl-5,6-dimethoxy-3-phenyl-3H-1,2-benzothiazole 1-oxide CAS Name: (3S)-5,6-dimethoxy-3-phenyl-2-(phenylmethyl)-3H-1,2-benzothiazole 1-oxide IUPAC Name: (3S)-2-benzyl-5,6-dimethoxy-3-phenyl-3H-1,2-benzothiazole 1-oxide Traditional Name: (3S)-2-benzyl-5,6-dimethoxy-3-phenyl-3H-1,2-benzothiazole 1-oxide Formula: C22H21NO3S MolecularWeight: 379.47204

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(N(S2=O)CC3=CC=CC=C3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)[C@@H](N(S2=O)CC3=CC=CC=C3)C4=CC=CC=C4)OC

InChI

InChI=1S/C22H21NO3S/c1-25-19-13-18-21(14-20(19)26-2)27(24)23(15-16-9-5-3-6-10-16)22(18)17-11-7-4-8-12-17/h3-14,22H,15H2,1-2H3/t22-,27?/m0/s1