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

Systemtic Name: 6-[[[2-[(4-bromophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]amino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: 6-[[[2-[(4-bromophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]amino]methylene]cyclohexa-2,4-dien-1-one CAS Name: 6-[[[2-[(4-bromophenyl)methylthio]-1,3-benzothiazol-6-yl]amino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[[2-[(4-bromophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]amino]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: 6-[[[2-[(4-bromobenzyl)thio]-1,3-benzothiazol-6-yl]amino]methylene]cyclohexa-2,4-dien-1-one Formula: C21H15BrN2OS2 MolecularWeight: 455.3906

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CNC2=CC3=C(C=C2)N=C(S3)SCC4=CC=C(C=C4)Br)C(=O)C=C1

Isomeric SMILES

C1=CC(=CNC2=CC3=C(C=C2)N=C(S3)SCC4=CC=C(C=C4)Br)C(=O)C=C1

InChI

InChI=1S/C21H15BrN2OS2/c22-16-7-5-14(6-8-16)13-26-21-24-18-10-9-17(11-20(18)27-21)23-12-15-3-1-2-4-19(15)25/h1-12,23H,13H2