2-[3-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylpropylsulfanyl]-1,3-benzothiazole

Systemtic Name: 2-[3-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylpropylsulfanyl]-1,3-benzothiazole Openeye Name: 2-[3-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylpropylsulfanyl]-1,3-benzothiazole CAS Name: 2-[3-[[4-(2-pyrazinyl)-1-piperazinyl]sulfonyl]propylthio]-1,3-benzothiazole IUPAC Name: 2-[3-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylpropylsulfanyl]-1,3-benzothiazole Traditional Name: 2-[3-(4-pyrazin-2-ylpiperazino)sulfonylpropylthio]-1,3-benzothiazole Formula: C18H21N5O2S3 MolecularWeight: 435.58664

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CN=C2)S(=O)(=O)CCCSC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CN(CCN1C2=NC=CN=C2)S(=O)(=O)CCCSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H21N5O2S3/c24-28(25,23-10-8-22(9-11-23)17-14-19-6-7-20-17)13-3-12-26-18-21-15-4-1-2-5-16(15)27-18/h1-2,4-7,14H,3,8-13H2