3,6-bis(chloranyl)-N-[6-chloranyl-2-(4-methylphenyl)benzotriazol-5-yl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3,6-bis(chloranyl)-N-[6-chloranyl-2-(4-methylphenyl)benzotriazol-5-yl]-1-benzothiophene-2-carboxamide Openeye Name: 3,6-dichloro-N-[6-chloro-2-(p-tolyl)benzotriazol-5-yl]benzothiophene-2-carboxamide CAS Name: 3,6-dichloro-N-[6-chloro-2-(4-methylphenyl)-5-benzotriazolyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3,6-dichloro-N-[6-chloro-2-(4-methylphenyl)benzotriazol-5-yl]-1-benzothiophene-2-carboxamide Traditional Name: 3,6-dichloro-N-[6-chloro-2-(p-tolyl)benzotriazol-5-yl]benzothiophene-2-carboxamide Formula: C22H13Cl3N4OS MolecularWeight: 487.78882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)Cl)NC(=O)C4=C(C5=C(S4)C=C(C=C5)Cl)Cl

Isomeric SMILES

CC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)Cl)NC(=O)C4=C(C5=C(S4)C=C(C=C5)Cl)Cl

InChI

InChI=1S/C22H13Cl3N4OS/c1-11-2-5-13(6-3-11)29-27-17-9-15(24)16(10-18(17)28-29)26-22(30)21-20(25)14-7-4-12(23)8-19(14)31-21/h2-10H,1H3,(H,26,30)