6-methoxy-2-[3-(6-methoxy-1,3-benzothiazol-2-yl)-5-phenethyl-1,3,5-triazinan-1-yl]-1,3-benzothiazole

Systemtic Name: 6-methoxy-2-[3-(6-methoxy-1,3-benzothiazol-2-yl)-5-phenethyl-1,3,5-triazinan-1-yl]-1,3-benzothiazole Openeye Name: 6-methoxy-2-[3-(6-methoxy-1,3-benzothiazol-2-yl)-5-phenethyl-1,3,5-triazinan-1-yl]-1,3-benzothiazole CAS Name: 6-methoxy-2-[3-(6-methoxy-1,3-benzothiazol-2-yl)-5-phenethyl-1,3,5-triazinan-1-yl]-1,3-benzothiazole IUPAC Name: 6-methoxy-2-[3-(6-methoxy-1,3-benzothiazol-2-yl)-5-phenethyl-1,3,5-triazinan-1-yl]-1,3-benzothiazole Traditional Name: 6-methoxy-2-[3-(6-methoxy-1,3-benzothiazol-2-yl)-5-phenethyl-1,3,5-triazinan-1-yl]-1,3-benzothiazole Formula: C27H27N5O2S2 MolecularWeight: 517.66558

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)N3CN(CN(C3)C4=NC5=C(S4)C=C(C=C5)OC)CCC6=CC=CC=C6

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)N3CN(CN(C3)C4=NC5=C(S4)C=C(C=C5)OC)CCC6=CC=CC=C6

InChI

InChI=1S/C27H27N5O2S2/c1-33-20-8-10-22-24(14-20)35-26(28-22)31-16-30(13-12-19-6-4-3-5-7-19)17-32(18-31)27-29-23-11-9-21(34-2)15-25(23)36-27/h3-11,14-15H,12-13,16-18H2,1-2H3