5,6-dimethoxy-N-(4-nitrophenyl)-1,3-benzothiazol-2-amine

Systemtic Name: 5,6-dimethoxy-N-(4-nitrophenyl)-1,3-benzothiazol-2-amine Openeye Name: 5,6-dimethoxy-N-(4-nitrophenyl)-1,3-benzothiazol-2-amine CAS Name: 5,6-dimethoxy-N-(4-nitrophenyl)-1,3-benzothiazol-2-amine IUPAC Name: 5,6-dimethoxy-N-(4-nitrophenyl)-1,3-benzothiazol-2-amine Traditional Name: (5,6-dimethoxy-1,3-benzothiazol-2-yl)-(4-nitrophenyl)amine Formula: C15H13N3O4S MolecularWeight: 331.34642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=C(S2)NC3=CC=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C2C(=C1)N=C(S2)NC3=CC=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C15H13N3O4S/c1-21-12-7-11-14(8-13(12)22-2)23-15(17-11)16-9-3-5-10(6-4-9)18(19)20/h3-8H,1-2H3,(H,16,17)