3-bromanyl-5-[[4-chloranyl-2-(phenylcarbonyl)phenyl]amino]-1,2-thiazole-4-carbonitrile

Systemtic Name: 3-bromanyl-5-[[4-chloranyl-2-(phenylcarbonyl)phenyl]amino]-1,2-thiazole-4-carbonitrile Openeye Name: 5-(2-benzoyl-4-chloro-anilino)-3-bromo-isothiazole-4-carbonitrile CAS Name: 5-(2-benzoyl-4-chloroanilino)-3-bromo-4-isothiazolecarbonitrile IUPAC Name: 5-(2-benzoyl-4-chloroanilino)-3-bromo-1,2-thiazole-4-carbonitrile Traditional Name: 5-(2-benzoyl-4-chloro-anilino)-3-bromo-isothiazole-4-carbonitrile Formula: C17H9BrClN3OS MolecularWeight: 418.69486

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)Cl)NC3=C(C(=NS3)Br)C#N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)Cl)NC3=C(C(=NS3)Br)C#N

InChI

InChI=1S/C17H9BrClN3OS/c18-16-13(9-20)17(24-22-16)21-14-7-6-11(19)8-12(14)15(23)10-4-2-1-3-5-10/h1-8,21H