N-[(E)-(3-bromanyl-4-methoxy-phenyl)methylideneamino]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-amine

Systemtic Name: N-[(E)-(3-bromanyl-4-methoxy-phenyl)methylideneamino]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-amine Openeye Name: N-[(E)-(3-bromo-4-methoxy-phenyl)methyleneamino]-1,1-dioxo-1,2-benzothiazol-3-amine CAS Name: N-[(E)-(3-bromo-4-methoxyphenyl)methylideneamino]-1,1-dioxo-1,2-benzothiazol-3-amine IUPAC Name: N-[(E)-(3-bromo-4-methoxyphenyl)methylideneamino]-1,1-dioxo-1,2-benzothiazol-3-amine Traditional Name: [(E)-(3-bromo-4-methoxy-benzylidene)amino]-(1,1-diketo-1,2-benzothiazol-3-yl)amine Formula: C15H12BrN3O3S MolecularWeight: 394.24308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NNC2=NS(=O)(=O)C3=CC=CC=C32)Br

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N/NC2=NS(=O)(=O)C3=CC=CC=C32)Br

InChI

InChI=1S/C15H12BrN3O3S/c1-22-13-7-6-10(8-12(13)16)9-17-18-15-11-4-2-3-5-14(11)23(20,21)19-15/h2-9H,1H3,(H,18,19)/b17-9+