2-(4-tert-butylphenyl)sulfonyl-4-piperazin-1-yl-thieno[3,2-c]pyridine hydrochloride

Systemtic Name: 2-(4-tert-butylphenyl)sulfonyl-4-piperazin-1-yl-thieno[3,2-c]pyridine hydrochloride Openeye Name: 2-(4-tert-butylphenyl)sulfonyl-4-piperazin-1-yl-thieno[3,2-c]pyridine hydrochloride CAS Name: 2-(4-tert-butylphenyl)sulfonyl-4-(1-piperazinyl)thieno[3,2-c]pyridine hydrochloride IUPAC Name: 2-(4-tert-butylphenyl)sulfonyl-4-piperazin-1-ylthieno[3,2-c]pyridine hydrochloride Traditional Name: 2-(4-tert-butylphenyl)sulfonyl-4-piperazino-thieno[3,2-c]pyridine hydrochloride Formula: C21H26ClN3O2S2 MolecularWeight: 452.03304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)C2=CC3=C(S2)C=CN=C3N4CCNCC4.Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)C2=CC3=C(S2)C=CN=C3N4CCNCC4.Cl

InChI

InChI=1S/C21H25N3O2S2.ClH/c1-21(2,3)15-4-6-16(7-5-15)28(25,26)19-14-17-18(27-19)8-9-23-20(17)24-12-10-22-11-13-24;/h4-9,14,22H,10-13H2,1-3H3;1H