2-[3-butyl-5-(6-ethoxy-1,3-benzothiazol-2-yl)-1,3,5-triazinan-1-yl]-6-ethoxy-1,3-benzothiazole

Systemtic Name: 2-[3-butyl-5-(6-ethoxy-1,3-benzothiazol-2-yl)-1,3,5-triazinan-1-yl]-6-ethoxy-1,3-benzothiazole Openeye Name: 2-[3-butyl-5-(6-ethoxy-1,3-benzothiazol-2-yl)-1,3,5-triazinan-1-yl]-6-ethoxy-1,3-benzothiazole CAS Name: 2-[3-butyl-5-(6-ethoxy-1,3-benzothiazol-2-yl)-1,3,5-triazinan-1-yl]-6-ethoxy-1,3-benzothiazole IUPAC Name: 2-[3-butyl-5-(6-ethoxy-1,3-benzothiazol-2-yl)-1,3,5-triazinan-1-yl]-6-ethoxy-1,3-benzothiazole Traditional Name: 2-[3-butyl-5-(6-ethoxy-1,3-benzothiazol-2-yl)-1,3,5-triazinan-1-yl]-6-ethoxy-1,3-benzothiazole Formula: C25H31N5O2S2 MolecularWeight: 497.67594

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CN(CN(C1)C2=NC3=C(S2)C=C(C=C3)OCC)C4=NC5=C(S4)C=C(C=C5)OCC

Isomeric SMILES

CCCCN1CN(CN(C1)C2=NC3=C(S2)C=C(C=C3)OCC)C4=NC5=C(S4)C=C(C=C5)OCC

InChI

InChI=1S/C25H31N5O2S2/c1-4-7-12-28-15-29(24-26-20-10-8-18(31-5-2)13-22(20)33-24)17-30(16-28)25-27-21-11-9-19(32-6-3)14-23(21)34-25/h8-11,13-14H,4-7,12,15-17H2,1-3H3