2-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]-6-nitro-1,3-benzothiazole

Systemtic Name: 2-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]-6-nitro-1,3-benzothiazole Openeye Name: 2-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]-6-nitro-1,3-benzothiazole CAS Name: 2-[4-[(2-chlorophenyl)methyl]-1-piperazinyl]-6-nitro-1,3-benzothiazole IUPAC Name: 2-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]-6-nitro-1,3-benzothiazole Traditional Name: 2-[4-(2-chlorobenzyl)piperazino]-6-nitro-1,3-benzothiazole Formula: C18H17ClN4O2S MolecularWeight: 388.87118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2Cl)C3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2Cl)C3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H17ClN4O2S/c19-15-4-2-1-3-13(15)12-21-7-9-22(10-8-21)18-20-16-6-5-14(23(24)25)11-17(16)26-18/h1-6,11H,7-10,12H2