ethyl 2-[bis[4-(quinolin-2-ylmethoxy)phenyl]-thiophen-2-yl-methyl]sulfanylethanoate

Systemtic Name: ethyl 2-[bis[4-(quinolin-2-ylmethoxy)phenyl]-thiophen-2-yl-methyl]sulfanylethanoate Openeye Name: ethyl 2-[bis[4-(2-quinolylmethoxy)phenyl]-(2-thienyl)methyl]sulfanylacetate CAS Name: 2-[[bis[4-(2-quinolinylmethoxy)phenyl]-thiophen-2-ylmethyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[bis[4-(quinolin-2-ylmethoxy)phenyl]-thiophen-2-ylmethyl]sulfanylacetate Traditional Name: 2-[[bis[4-(2-quinolylmethoxy)phenyl]-(2-thienyl)methyl]thio]acetic acid ethyl ester Formula: C41H34N2O4S2 MolecularWeight: 682.84966

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC(C1=CC=C(C=C1)OCC2=NC3=CC=CC=C3C=C2)(C4=CC=C(C=C4)OCC5=NC6=CC=CC=C6C=C5)C7=CC=CS7

Isomeric SMILES

CCOC(=O)CSC(C1=CC=C(C=C1)OCC2=NC3=CC=CC=C3C=C2)(C4=CC=C(C=C4)OCC5=NC6=CC=CC=C6C=C5)C7=CC=CS7

InChI

InChI=1S/C41H34N2O4S2/c1-2-45-40(44)28-49-41(39-12-7-25-48-39,31-15-21-35(22-16-31)46-26-33-19-13-29-8-3-5-10-37(29)42-33)32-17-23-36(24-18-32)47-27-34-20-14-30-9-4-6-11-38(30)43-34/h3-25H,2,26-28H2,1H3