1-[2-[4-[[6-methoxy-2-(4-methoxyphenyl)-1-benzothiophen-3-yl]oxy]phenyl]sulfanyloxyethyl]pyrrolidine

Systemtic Name: 1-[2-[4-[[6-methoxy-2-(4-methoxyphenyl)-1-benzothiophen-3-yl]oxy]phenyl]sulfanyloxyethyl]pyrrolidine Openeye Name: 1-[2-[4-[6-methoxy-2-(4-methoxyphenyl)benzothiophen-3-yl]oxyphenyl]sulfanyloxyethyl]pyrrolidine CAS Name: 4-[[6-methoxy-2-(4-methoxyphenyl)-1-benzothiophen-3-yl]oxy]benzenesulfenic acid 2-(1-pyrrolidinyl)ethyl ester IUPAC Name: 1-[2-[4-[[6-methoxy-2-(4-methoxyphenyl)-1-benzothiophen-3-yl]oxy]phenyl]sulfanyloxyethyl]pyrrolidine Traditional Name: 1-[2-[[4-[6-methoxy-2-(4-methoxyphenyl)benzothiophen-3-yl]oxyphenyl]thio]oxyethyl]pyrrolidine Formula: C28H29NO4S2 MolecularWeight: 507.66416

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C3=C(S2)C=C(C=C3)OC)OC4=CC=C(C=C4)SOCCN5CCCC5

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C3=C(S2)C=C(C=C3)OC)OC4=CC=C(C=C4)SOCCN5CCCC5

InChI

InChI=1S/C28H29NO4S2/c1-30-21-7-5-20(6-8-21)28-27(25-14-11-23(31-2)19-26(25)34-28)33-22-9-12-24(13-10-22)35-32-18-17-29-15-3-4-16-29/h5-14,19H,3-4,15-18H2,1-2H3