3,6-bis(chloranyl)-N-(2-phenylbenzotriazol-5-yl)-1-benzothiophene-2-carboxamide

Systemtic Name: 3,6-bis(chloranyl)-N-(2-phenylbenzotriazol-5-yl)-1-benzothiophene-2-carboxamide Openeye Name: 3,6-dichloro-N-(2-phenylbenzotriazol-5-yl)benzothiophene-2-carboxamide CAS Name: 3,6-dichloro-N-(2-phenyl-5-benzotriazolyl)-1-benzothiophene-2-carboxamide IUPAC Name: 3,6-dichloro-N-(2-phenylbenzotriazol-5-yl)-1-benzothiophene-2-carboxamide Traditional Name: 3,6-dichloro-N-(2-phenylbenzotriazol-5-yl)benzothiophene-2-carboxamide Formula: C21H12Cl2N4OS MolecularWeight: 439.31718

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H12Cl2N4OS/c22-12-6-8-15-18(10-12)29-20(19(15)23)21(28)24-13-7-9-16-17(11-13)26-27(25-16)14-4-2-1-3-5-14/h1-11H,(H,24,28)