3,6-bis(chloranyl)-N-(2-prop-2-enyl-1,2,3,4-tetrazol-5-yl)-1-benzothiophene-2-carboxamide

Systemtic Name: 3,6-bis(chloranyl)-N-(2-prop-2-enyl-1,2,3,4-tetrazol-5-yl)-1-benzothiophene-2-carboxamide Openeye Name: N-(2-allyltetrazol-5-yl)-3,6-dichloro-benzothiophene-2-carboxamide CAS Name: 3,6-dichloro-N-(2-prop-2-enyl-5-tetrazolyl)-1-benzothiophene-2-carboxamide IUPAC Name: 3,6-dichloro-N-(2-prop-2-enyltetrazol-5-yl)-1-benzothiophene-2-carboxamide Traditional Name: N-(2-allyltetrazol-5-yl)-3,6-dichloro-benzothiophene-2-carboxamide Formula: C13H9Cl2N5OS MolecularWeight: 354.21446

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1N=C(N=N1)NC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl

Isomeric SMILES

C=CCN1N=C(N=N1)NC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl

InChI

InChI=1S/C13H9Cl2N5OS/c1-2-5-20-18-13(17-19-20)16-12(21)11-10(15)8-4-3-7(14)6-9(8)22-11/h2-4,6H,1,5H2,(H,16,18,21)