N-[6-[(3-chloranyl-7-nitro-1-benzothiophen-2-yl)carbonylamino]-1,3-benzothiazol-2-yl]furan-2-carboxamide

Systemtic Name: N-[6-[(3-chloranyl-7-nitro-1-benzothiophen-2-yl)carbonylamino]-1,3-benzothiazol-2-yl]furan-2-carboxamide Openeye Name: N-[6-[(3-chloro-7-nitro-benzothiophene-2-carbonyl)amino]-1,3-benzothiazol-2-yl]furan-2-carboxamide CAS Name: N-[6-[[(3-chloro-7-nitro-1-benzothiophen-2-yl)-oxomethyl]amino]-1,3-benzothiazol-2-yl]-2-furancarboxamide IUPAC Name: N-[6-[(3-chloro-7-nitro-1-benzothiophene-2-carbonyl)amino]-1,3-benzothiazol-2-yl]furan-2-carboxamide Traditional Name: N-[6-[(3-chloro-7-nitro-benzothiophene-2-carbonyl)amino]-1,3-benzothiazol-2-yl]-2-furamide Formula: C21H11ClN4O5S2 MolecularWeight: 498.91884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)[N+](=O)[O-])SC(=C2Cl)C(=O)NC3=CC4=C(C=C3)N=C(S4)NC(=O)C5=CC=CO5

Isomeric SMILES

C1=CC2=C(C(=C1)[N+](=O)[O-])SC(=C2Cl)C(=O)NC3=CC4=C(C=C3)N=C(S4)NC(=O)C5=CC=CO5

InChI

InChI=1S/C21H11ClN4O5S2/c22-16-11-3-1-4-13(26(29)30)17(11)33-18(16)20(28)23-10-6-7-12-15(9-10)32-21(24-12)25-19(27)14-5-2-8-31-14/h1-9H,(H,23,28)(H,24,25,27)