N-[4-(1,3-benzothiazol-2-ylsulfanyl)-3-cyano-phenyl]-3,5-bis(chloranyl)-2-oxidanyl-benzamide

Systemtic Name: N-[4-(1,3-benzothiazol-2-ylsulfanyl)-3-cyano-phenyl]-3,5-bis(chloranyl)-2-oxidanyl-benzamide Openeye Name: N-[4-(1,3-benzothiazol-2-ylsulfanyl)-3-cyano-phenyl]-3,5-dichloro-2-hydroxy-benzamide CAS Name: N-[4-(1,3-benzothiazol-2-ylthio)-3-cyanophenyl]-3,5-dichloro-2-hydroxybenzamide IUPAC Name: N-[4-(1,3-benzothiazol-2-ylsulfanyl)-3-cyanophenyl]-3,5-dichloro-2-hydroxybenzamide Traditional Name: N-[4-(1,3-benzothiazol-2-ylthio)-3-cyano-phenyl]-3,5-dichloro-2-hydroxy-benzamide Formula: C21H11Cl2N3O2S2 MolecularWeight: 472.36694

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SC3=C(C=C(C=C3)NC(=O)C4=CC(=CC(=C4O)Cl)Cl)C#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SC3=C(C=C(C=C3)NC(=O)C4=CC(=CC(=C4O)Cl)Cl)C#N

InChI

InChI=1S/C21H11Cl2N3O2S2/c22-12-8-14(19(27)15(23)9-12)20(28)25-13-5-6-17(11(7-13)10-24)29-21-26-16-3-1-2-4-18(16)30-21/h1-9,27H,(H,25,28)