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

Systemtic Name: 2-[(4-bromophenyl)methylsulfonyl]-4-piperazin-1-yl-thieno[3,2-c]pyridine hydrochloride Openeye Name: 2-[(4-bromophenyl)methylsulfonyl]-4-piperazin-1-yl-thieno[3,2-c]pyridine hydrochloride CAS Name: 2-[(4-bromophenyl)methylsulfonyl]-4-(1-piperazinyl)thieno[3,2-c]pyridine hydrochloride IUPAC Name: 2-[(4-bromophenyl)methylsulfonyl]-4-piperazin-1-ylthieno[3,2-c]pyridine hydrochloride Traditional Name: 2-(4-bromobenzyl)sulfonyl-4-piperazino-thieno[3,2-c]pyridine hydrochloride Formula: C18H19BrClN3O2S2 MolecularWeight: 488.84936

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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