3-chloranyl-N-(3-imidazol-1-ylpropyl)-6-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-(3-imidazol-1-ylpropyl)-6-nitro-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-(3-imidazol-1-ylpropyl)-6-nitro-benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[3-(1-imidazolyl)propyl]-6-nitro-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-(3-imidazol-1-ylpropyl)-6-nitro-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-(3-imidazol-1-ylpropyl)-6-nitro-benzothiophene-2-carboxamide Formula: C15H13ClN4O3S MolecularWeight: 364.80672

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])SC(=C2Cl)C(=O)NCCCN3C=CN=C3

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])SC(=C2Cl)C(=O)NCCCN3C=CN=C3

InChI

InChI=1S/C15H13ClN4O3S/c16-13-11-3-2-10(20(22)23)8-12(11)24-14(13)15(21)18-4-1-6-19-7-5-17-9-19/h2-3,5,7-9H,1,4,6H2,(H,18,21)