(2S)-1-[[3-[(2S)-2-oxidanyl-3-phenoxy-propyl]-1,3-benzothiazol-2-ylidene]amino]-3-phenoxy-propan-2-ol

Systemtic Name: (2S)-1-[[3-[(2S)-2-oxidanyl-3-phenoxy-propyl]-1,3-benzothiazol-2-ylidene]amino]-3-phenoxy-propan-2-ol Openeye Name: (2S)-1-[[3-[(2S)-2-hydroxy-3-phenoxy-propyl]-1,3-benzothiazol-2-ylidene]amino]-3-phenoxy-propan-2-ol CAS Name: (2S)-1-[[3-[(2S)-2-hydroxy-3-phenoxypropyl]-1,3-benzothiazol-2-ylidene]amino]-3-phenoxy-2-propanol IUPAC Name: (2S)-1-[[3-[(2S)-2-hydroxy-3-phenoxypropyl]-1,3-benzothiazol-2-ylidene]amino]-3-phenoxypropan-2-ol Traditional Name: (2S)-1-[[3-[(2S)-2-hydroxy-3-phenoxy-propyl]-1,3-benzothiazol-2-ylidene]amino]-3-phenoxy-propan-2-ol Formula: C25H26N2O4S MolecularWeight: 450.54994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC(CN=C2N(C3=CC=CC=C3S2)CC(COC4=CC=CC=C4)O)O

Isomeric SMILES

C1=CC=C(C=C1)OC[C@H](CN=C2N(C3=CC=CC=C3S2)C[C@@H](COC4=CC=CC=C4)O)O

InChI

InChI=1S/C25H26N2O4S/c28-19(17-30-21-9-3-1-4-10-21)15-26-25-27(23-13-7-8-14-24(23)32-25)16-20(29)18-31-22-11-5-2-6-12-22/h1-14,19-20,28-29H,15-18H2/t19-,20-/m0/s1