3-(3-bromo-4-pyrrolidin-1-ylmethyl-benzyl)-2-[4-pyrrolidin-1-yl-ethoxy)-phenyl]-benzo[b]thiophen-6-ol (Q27458586)

CHEMBL275206 (English)

19 October 2016

chemical formula

C₃₂H₃₅BrN₂O₂S

1 reference

CHEMBL275206 (English)

19 October 2016

canonical SMILES

C1CCN(C1)CCOC2=CC=C(C=C2)C3=C(C4=C(S3)C=C(C=C4)O)CC5=CC(=C(C=C5)CN6CCCC6)Br

1 reference

CHEMBL275206 (English)

InChI=1S/C32H35BrN2O2S/c33-30-20-23(5-6-25(30)22-35-15-3-4-16-35)19-29-28-12-9-26(36)21-31(28)38-32(29)24-7-10-27(11-8-24)37-18-17-34-13-1-2-14-34/h5-12,20-21,36H,1-4,13-19,22H2

19 October 2016

Identifiers

InChI

1 reference

CHEMBL275206 (English)

QVDZMCVSIVITGR-UHFFFAOYSA-N

19 October 2016

InChIKey

1 reference

CHEMBL275206 (English)

19 October 2016

1 reference

3-[3-Bromo-4-(1-pyrrolidinylmethyl)benzyl]-2-{4-[2-(1-pyrrolidinyl)ethoxy]phenyl}-1-benzothiophene-6-ol (English)

19 October 2016

2 references

CHEMBL275206 (English)

matched by identifier from

19 October 2016

InChIKey

QVDZMCVSIVITGR-UHFFFAOYSA-N

1 reference

CHEMBL275206 (English)

19 October 2016

1 reference

0 references

1 reference

1D3D (English)