2-[(3-bromophenyl)methylsulfonyl]-4-piperazin-1-yl-thieno[3,2-c]pyridine

Systemtic Name: 2-[(3-bromophenyl)methylsulfonyl]-4-piperazin-1-yl-thieno[3,2-c]pyridine Openeye Name: 2-[(3-bromophenyl)methylsulfonyl]-4-piperazin-1-yl-thieno[3,2-c]pyridine CAS Name: 2-[(3-bromophenyl)methylsulfonyl]-4-(1-piperazinyl)thieno[3,2-c]pyridine IUPAC Name: 2-[(3-bromophenyl)methylsulfonyl]-4-piperazin-1-ylthieno[3,2-c]pyridine Traditional Name: 2-(3-bromobenzyl)sulfonyl-4-piperazino-thieno[3,2-c]pyridine Formula: C18H18BrN3O2S2 MolecularWeight: 452.38842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=NC=CC3=C2C=C(S3)S(=O)(=O)CC4=CC(=CC=C4)Br

Isomeric SMILES

C1CN(CCN1)C2=NC=CC3=C2C=C(S3)S(=O)(=O)CC4=CC(=CC=C4)Br

InChI

InChI=1S/C18H18BrN3O2S2/c19-14-3-1-2-13(10-14)12-26(23,24)17-11-15-16(25-17)4-5-21-18(15)22-8-6-20-7-9-22/h1-5,10-11,20H,6-9,12H2