4-(4-thieno[2,3-d]pyrimidin-4-ylpiperazin-1-yl)sulfonylbenzenesulfonamide

Systemtic Name: 4-(4-thieno[2,3-d]pyrimidin-4-ylpiperazin-1-yl)sulfonylbenzenesulfonamide Openeye Name: 4-(4-thieno[2,3-d]pyrimidin-4-ylpiperazin-1-yl)sulfonylbenzenesulfonamide CAS Name: 4-[[4-(4-thieno[2,3-d]pyrimidinyl)-1-piperazinyl]sulfonyl]benzenesulfonamide IUPAC Name: 4-(4-thieno[2,3-d]pyrimidin-4-ylpiperazin-1-yl)sulfonylbenzenesulfonamide Traditional Name: 4-(4-thieno[2,3-d]pyrimidin-4-ylpiperazino)sulfonylbenzenesulfonamide Formula: C16H17N5O4S3 MolecularWeight: 439.53228

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C3C=CSC3=NC=N2)S(=O)(=O)C4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

C1CN(CCN1C2=C3C=CSC3=NC=N2)S(=O)(=O)C4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C16H17N5O4S3/c17-27(22,23)12-1-3-13(4-2-12)28(24,25)21-8-6-20(7-9-21)15-14-5-10-26-16(14)19-11-18-15/h1-5,10-11H,6-9H2,(H2,17,22,23)