6-[[[2-(3-bromophenyl)-1,3-benzothiazol-5-yl]amino]methylidene]-4-chloranyl-2-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[[2-(3-bromophenyl)-1,3-benzothiazol-5-yl]amino]methylidene]-4-chloranyl-2-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[[2-(3-bromophenyl)-1,3-benzothiazol-5-yl]amino]methylene]-4-chloro-2-nitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[[[2-(3-bromophenyl)-1,3-benzothiazol-5-yl]amino]methylidene]-4-chloro-2-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[[2-(3-bromophenyl)-1,3-benzothiazol-5-yl]amino]methylidene]-4-chloro-2-nitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[[[2-(3-bromophenyl)-1,3-benzothiazol-5-yl]amino]methylene]-4-chloro-2-nitro-cyclohexa-2,4-dien-1-one Formula: C20H11BrClN3O3S MolecularWeight: 488.74164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C2=NC3=C(S2)C=CC(=C3)NC=C4C=C(C=C(C4=O)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC(=C1)Br)C2=NC3=C(S2)C=CC(=C3)NC=C4C=C(C=C(C4=O)[N+](=O)[O-])Cl

InChI

InChI=1S/C20H11BrClN3O3S/c21-13-3-1-2-11(6-13)20-24-16-9-15(4-5-18(16)29-20)23-10-12-7-14(22)8-17(19(12)26)25(27)28/h1-10,23H