2,1,3-benzothiadiazol-5-yl-[4-(4-nitrophenyl)piperazin-1-yl]methanone

Systemtic Name: 2,1,3-benzothiadiazol-5-yl-[4-(4-nitrophenyl)piperazin-1-yl]methanone Openeye Name: 2,1,3-benzothiadiazol-5-yl-[4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: 2,1,3-benzothiadiazol-5-yl-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: 2,1,3-benzothiadiazol-5-yl-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: [4-(4-nitrophenyl)piperazino]-piazthiol-5-yl-methanone Formula: C17H15N5O3S MolecularWeight: 369.3977

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC4=NSN=C4C=C3

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC4=NSN=C4C=C3

InChI

InChI=1S/C17H15N5O3S/c23-17(12-1-6-15-16(11-12)19-26-18-15)21-9-7-20(8-10-21)13-2-4-14(5-3-13)22(24)25/h1-6,11H,7-10H2