2-[(6-azanyl-1,3-benzothiazol-2-yl)sulfanyl]-1-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone

Systemtic Name: 2-[(6-azanyl-1,3-benzothiazol-2-yl)sulfanyl]-1-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone Openeye Name: 2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]-1-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone CAS Name: 2-[(6-amino-1,3-benzothiazol-2-yl)thio]-1-[4-(1,3-benzothiazol-2-yl)-1-piperazinyl]ethanone IUPAC Name: 2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]-1-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone Traditional Name: 2-[(6-amino-1,3-benzothiazol-2-yl)thio]-1-[4-(1,3-benzothiazol-2-yl)piperazino]ethanone Formula: C20H19N5OS3 MolecularWeight: 441.59276

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC3=CC=CC=C3S2)C(=O)CSC4=NC5=C(S4)C=C(C=C5)N

Isomeric SMILES

C1CN(CCN1C2=NC3=CC=CC=C3S2)C(=O)CSC4=NC5=C(S4)C=C(C=C5)N

InChI

InChI=1S/C20H19N5OS3/c21-13-5-6-15-17(11-13)29-20(23-15)27-12-18(26)24-7-9-25(10-8-24)19-22-14-3-1-2-4-16(14)28-19/h1-6,11H,7-10,12,21H2