(2S,3R)-2-(benzotriazol-1-yl)-6-methoxy-3-phenyl-2-propyl-1-benzothiophen-3-ol

Systemtic Name: (2S,3R)-2-(benzotriazol-1-yl)-6-methoxy-3-phenyl-2-propyl-1-benzothiophen-3-ol Openeye Name: (2S,3R)-2-(benzotriazol-1-yl)-6-methoxy-3-phenyl-2-propyl-benzothiophen-3-ol CAS Name: (2S,3R)-2-(1-benzotriazolyl)-6-methoxy-3-phenyl-2-propyl-1-benzothiophen-3-ol IUPAC Name: (2S,3R)-2-(benzotriazol-1-yl)-6-methoxy-3-phenyl-2-propyl-1-benzothiophen-3-ol Traditional Name: (2S,3R)-2-(benzotriazol-1-yl)-6-methoxy-3-phenyl-2-propyl-benzothiophen-3-ol Formula: C24H23N3O2S MolecularWeight: 417.52332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C(C2=C(S1)C=C(C=C2)OC)(C3=CC=CC=C3)O)N4C5=CC=CC=C5N=N4

Isomeric SMILES

CCC[C@]1([C@](C2=C(S1)C=C(C=C2)OC)(C3=CC=CC=C3)O)N4C5=CC=CC=C5N=N4

InChI

InChI=1S/C24H23N3O2S/c1-3-15-23(27-21-12-8-7-11-20(21)25-26-27)24(28,17-9-5-4-6-10-17)19-14-13-18(29-2)16-22(19)30-23/h4-14,16,28H,3,15H2,1-2H3/t23-,24+/m0/s1