1-(2-nitrophenyl)-N-[2-(phenylmethylsulfanyl)-1,3-benzothiazol-6-yl]methanimine

Systemtic Name: 1-(2-nitrophenyl)-N-[2-(phenylmethylsulfanyl)-1,3-benzothiazol-6-yl]methanimine Openeye Name: N-(2-benzylsulfanyl-1,3-benzothiazol-6-yl)-1-(2-nitrophenyl)methanimine CAS Name: 1-(2-nitrophenyl)-N-[2-(phenylmethylthio)-1,3-benzothiazol-6-yl]methanimine IUPAC Name: N-(2-benzylsulfanyl-1,3-benzothiazol-6-yl)-1-(2-nitrophenyl)methanimine Traditional Name: [2-(benzylthio)-1,3-benzothiazol-6-yl]-(2-nitrobenzylidene)amine Formula: C21H15N3O2S2 MolecularWeight: 405.4927

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC3=C(S2)C=C(C=C3)N=CC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC3=C(S2)C=C(C=C3)N=CC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C21H15N3O2S2/c25-24(26)19-9-5-4-8-16(19)13-22-17-10-11-18-20(12-17)28-21(23-18)27-14-15-6-2-1-3-7-15/h1-13H,14H2