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

Systemtic Name: 2-[(6-azanyl-1,3-benzothiazol-2-yl)sulfanyl]-1-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone Openeye Name: 2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]-1-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone CAS Name: 2-[(6-amino-1,3-benzothiazol-2-yl)thio]-1-[4-(6-nitro-1,3-benzothiazol-2-yl)-1-piperazinyl]ethanone IUPAC Name: 2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]-1-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone Traditional Name: 2-[(6-amino-1,3-benzothiazol-2-yl)thio]-1-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazino]ethanone Formula: C20H18N6O3S3 MolecularWeight: 486.59032

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])C(=O)CSC4=NC5=C(S4)C=C(C=C5)N

Isomeric SMILES

C1CN(CCN1C2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])C(=O)CSC4=NC5=C(S4)C=C(C=C5)N

InChI

InChI=1S/C20H18N6O3S3/c21-12-1-3-15-16(9-12)32-20(23-15)30-11-18(27)24-5-7-25(8-6-24)19-22-14-4-2-13(26(28)29)10-17(14)31-19/h1-4,9-10H,5-8,11,21H2