N-(1,3-benzothiazol-2-ylmethyl)-5-nitro-thiophene-2-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-5-nitro-thiophene-2-carboxamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-5-nitro-thiophene-2-carboxamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-5-nitro-2-thiophenecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-5-nitrothiophene-2-carboxamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-5-nitro-thiophene-2-carboxamide Formula: C13H9N3O3S2 MolecularWeight: 319.35886

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CNC(=O)C3=CC=C(S3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CNC(=O)C3=CC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C13H9N3O3S2/c17-13(10-5-6-12(21-10)16(18)19)14-7-11-15-8-3-1-2-4-9(8)20-11/h1-6H,7H2,(H,14,17)