6-ethoxy-2-[4-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]but-2-ynylsulfanyl]-1,3-benzothiazole

Systemtic Name: 6-ethoxy-2-[4-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]but-2-ynylsulfanyl]-1,3-benzothiazole Openeye Name: 6-ethoxy-2-[4-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]but-2-ynylsulfanyl]-1,3-benzothiazole CAS Name: 6-ethoxy-2-[4-[(6-ethoxy-1,3-benzothiazol-2-yl)thio]but-2-ynylthio]-1,3-benzothiazole IUPAC Name: 6-ethoxy-2-[4-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]but-2-ynylsulfanyl]-1,3-benzothiazole Traditional Name: 6-ethoxy-2-[4-[(6-ethoxy-1,3-benzothiazol-2-yl)thio]but-2-ynylthio]-1,3-benzothiazole Formula: C22H20N2O2S4 MolecularWeight: 472.6664

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)SCC#CCSC3=NC4=C(S3)C=C(C=C4)OCC

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)SCC#CCSC3=NC4=C(S3)C=C(C=C4)OCC

InChI

InChI=1S/C22H20N2O2S4/c1-3-25-15-7-9-17-19(13-15)29-21(23-17)27-11-5-6-12-28-22-24-18-10-8-16(26-4-2)14-20(18)30-22/h7-10,13-14H,3-4,11-12H2,1-2H3