1-[(2R,3R)-3-(benzotriazol-1-yl)-1,4-dithian-2-yl]benzotriazole

Systemtic Name: 1-[(2R,3R)-3-(benzotriazol-1-yl)-1,4-dithian-2-yl]benzotriazole Openeye Name: 1-[(2R,3R)-3-(benzotriazol-1-yl)-1,4-dithian-2-yl]benzotriazole CAS Name: 1-[(2R,3R)-3-(1-benzotriazolyl)-1,4-dithian-2-yl]benzotriazole IUPAC Name: 1-[(2R,3R)-3-(benzotriazol-1-yl)-1,4-dithian-2-yl]benzotriazole Traditional Name: 1-[(2R,3R)-3-(benzotriazol-1-yl)-1,4-dithian-2-yl]benzotriazole Formula: C16H14N6S2 MolecularWeight: 354.45256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CSC(C(S1)N2C3=CC=CC=C3N=N2)N4C5=CC=CC=C5N=N4

Isomeric SMILES

C1CS[C@H]([C@@H](S1)N2C3=CC=CC=C3N=N2)N4C5=CC=CC=C5N=N4

InChI

InChI=1S/C16H14N6S2/c1-3-7-13-11(5-1)17-19-21(13)15-16(24-10-9-23-15)22-14-8-4-2-6-12(14)18-20-22/h1-8,15-16H,9-10H2/t15-,16-/m1/s1