ethyl 2-(4-methoxyphenyl)-2-(4-methoxy-2-pyrrol-1-yl-phenyl)sulfanyl-ethanoate

Systemtic Name: ethyl 2-(4-methoxyphenyl)-2-(4-methoxy-2-pyrrol-1-yl-phenyl)sulfanyl-ethanoate Openeye Name: ethyl 2-(4-methoxyphenyl)-2-(4-methoxy-2-pyrrol-1-yl-phenyl)sulfanyl-acetate CAS Name: 2-(4-methoxyphenyl)-2-[[4-methoxy-2-(1-pyrrolyl)phenyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-(4-methoxyphenyl)-2-(4-methoxy-2-pyrrol-1-ylphenyl)sulfanylacetate Traditional Name: 2-(4-methoxyphenyl)-2-[(4-methoxy-2-pyrrol-1-yl-phenyl)thio]acetic acid ethyl ester Formula: C22H23NO4S MolecularWeight: 397.48732

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=C(C=C1)OC)SC2=C(C=C(C=C2)OC)N3C=CC=C3

Isomeric SMILES

CCOC(=O)C(C1=CC=C(C=C1)OC)SC2=C(C=C(C=C2)OC)N3C=CC=C3

InChI

InChI=1S/C22H23NO4S/c1-4-27-22(24)21(16-7-9-17(25-2)10-8-16)28-20-12-11-18(26-3)15-19(20)23-13-5-6-14-23/h5-15,21H,4H2,1-3H3