1-(1,3-benzothiazol-2-yl)-1-phenyl-butane-1,2-diol

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-1-phenyl-butane-1,2-diol Openeye Name: 1-(1,3-benzothiazol-2-yl)-1-phenyl-butane-1,2-diol CAS Name: 1-(1,3-benzothiazol-2-yl)-1-phenylbutane-1,2-diol IUPAC Name: 1-(1,3-benzothiazol-2-yl)-1-phenylbutane-1,2-diol Traditional Name: 1-(1,3-benzothiazol-2-yl)-1-phenyl-butane-1,2-diol Formula: C17H17NO2S MolecularWeight: 299.38738

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C1=CC=CC=C1)(C2=NC3=CC=CC=C3S2)O)O

Isomeric SMILES

CCC(C(C1=CC=CC=C1)(C2=NC3=CC=CC=C3S2)O)O

InChI

InChI=1S/C17H17NO2S/c1-2-15(19)17(20,12-8-4-3-5-9-12)16-18-13-10-6-7-11-14(13)21-16/h3-11,15,19-20H,2H2,1H3