ethyl 2-[4,5-bis(4-methoxyphenyl)-2-(quinolin-2-ylmethylsulfanyl)imidazol-1-yl]ethanoate

Systemtic Name: ethyl 2-[4,5-bis(4-methoxyphenyl)-2-(quinolin-2-ylmethylsulfanyl)imidazol-1-yl]ethanoate Openeye Name: ethyl 2-[4,5-bis(4-methoxyphenyl)-2-(2-quinolylmethylsulfanyl)imidazol-1-yl]acetate CAS Name: 2-[4,5-bis(4-methoxyphenyl)-2-(2-quinolinylmethylthio)-1-imidazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4,5-bis(4-methoxyphenyl)-2-(quinolin-2-ylmethylsulfanyl)imidazol-1-yl]acetate Traditional Name: 2-[4,5-bis(4-methoxyphenyl)-2-(2-quinolylmethylthio)imidazol-1-yl]acetic acid ethyl ester Formula: C31H29N3O4S MolecularWeight: 539.64466

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C(=C(N=C1SCC2=NC3=CC=CC=C3C=C2)C4=CC=C(C=C4)OC)C5=CC=C(C=C5)OC

Isomeric SMILES

CCOC(=O)CN1C(=C(N=C1SCC2=NC3=CC=CC=C3C=C2)C4=CC=C(C=C4)OC)C5=CC=C(C=C5)OC

InChI

InChI=1S/C31H29N3O4S/c1-4-38-28(35)19-34-30(23-12-17-26(37-3)18-13-23)29(22-10-15-25(36-2)16-11-22)33-31(34)39-20-24-14-9-21-7-5-6-8-27(21)32-24/h5-18H,4,19-20H2,1-3H3