[3-(1,3-benzothiazol-2-yl)pyrazin-2-yl]-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone

Systemtic Name: [3-(1,3-benzothiazol-2-yl)pyrazin-2-yl]-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone Openeye Name: [3-(1,3-benzothiazol-2-yl)pyrazin-2-yl]-[4-(2-thienylsulfonyl)piperazin-1-yl]methanone CAS Name: [3-(1,3-benzothiazol-2-yl)-2-pyrazinyl]-(4-thiophen-2-ylsulfonyl-1-piperazinyl)methanone IUPAC Name: [3-(1,3-benzothiazol-2-yl)pyrazin-2-yl]-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone Traditional Name: [3-(1,3-benzothiazol-2-yl)pyrazin-2-yl]-[4-(2-thienylsulfonyl)piperazino]methanone Formula: C20H17N5O3S3 MolecularWeight: 471.57568

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=NC=CN=C2C3=NC4=CC=CC=C4S3)S(=O)(=O)C5=CC=CS5

Isomeric SMILES

C1CN(CCN1C(=O)C2=NC=CN=C2C3=NC4=CC=CC=C4S3)S(=O)(=O)C5=CC=CS5

InChI

InChI=1S/C20H17N5O3S3/c26-20(24-9-11-25(12-10-24)31(27,28)16-6-3-13-29-16)18-17(21-7-8-22-18)19-23-14-4-1-2-5-15(14)30-19/h1-8,13H,9-12H2