2-[3-(1,3-benzothiazol-2-yl)-5-phenethyl-1,3,5-triazinan-1-yl]-1,3-benzothiazole

Systemtic Name: 2-[3-(1,3-benzothiazol-2-yl)-5-phenethyl-1,3,5-triazinan-1-yl]-1,3-benzothiazole Openeye Name: 2-[3-(1,3-benzothiazol-2-yl)-5-phenethyl-1,3,5-triazinan-1-yl]-1,3-benzothiazole CAS Name: 2-[3-(1,3-benzothiazol-2-yl)-5-phenethyl-1,3,5-triazinan-1-yl]-1,3-benzothiazole IUPAC Name: 2-[3-(1,3-benzothiazol-2-yl)-5-phenethyl-1,3,5-triazinan-1-yl]-1,3-benzothiazole Traditional Name: 2-[3-(1,3-benzothiazol-2-yl)-5-phenethyl-1,3,5-triazinan-1-yl]-1,3-benzothiazole Formula: C25H23N5S2 MolecularWeight: 457.61362

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Descriptors Computed from Structure

Canonical SMILES:

C1N(CN(CN1C2=NC3=CC=CC=C3S2)C4=NC5=CC=CC=C5S4)CCC6=CC=CC=C6

Isomeric SMILES

C1N(CN(CN1C2=NC3=CC=CC=C3S2)C4=NC5=CC=CC=C5S4)CCC6=CC=CC=C6

InChI

InChI=1S/C25H23N5S2/c1-2-8-19(9-3-1)14-15-28-16-29(24-26-20-10-4-6-12-22(20)31-24)18-30(17-28)25-27-21-11-5-7-13-23(21)32-25/h1-13H,14-18H2