4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[(E)-(2-bromophenyl)methylideneamino]benzamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[(E)-(2-bromophenyl)methylideneamino]benzamide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[(E)-(2-bromophenyl)methyleneamino]benzamide CAS Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-N-[(E)-(2-bromophenyl)methylideneamino]benzamide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[(E)-(2-bromophenyl)methylideneamino]benzamide Traditional Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-N-[(E)-(2-bromobenzylidene)amino]benzamide Formula: C22H16BrN3OS2 MolecularWeight: 482.41594

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=NNC(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4S3)Br

Isomeric SMILES

C1=CC=C(C(=C1)/C=N/NC(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4S3)Br

InChI

InChI=1S/C22H16BrN3OS2/c23-18-6-2-1-5-17(18)13-24-26-21(27)16-11-9-15(10-12-16)14-28-22-25-19-7-3-4-8-20(19)29-22/h1-13H,14H2,(H,26,27)/b24-13+