N-[6-[(4-methoxy-3-nitro-phenyl)carbonylamino]-1,3-benzothiazol-2-yl]furan-2-carboxamide

Systemtic Name: N-[6-[(4-methoxy-3-nitro-phenyl)carbonylamino]-1,3-benzothiazol-2-yl]furan-2-carboxamide Openeye Name: N-[6-[(4-methoxy-3-nitro-benzoyl)amino]-1,3-benzothiazol-2-yl]furan-2-carboxamide CAS Name: N-[6-[[(4-methoxy-3-nitrophenyl)-oxomethyl]amino]-1,3-benzothiazol-2-yl]-2-furancarboxamide IUPAC Name: N-[6-[(4-methoxy-3-nitrobenzoyl)amino]-1,3-benzothiazol-2-yl]furan-2-carboxamide Traditional Name: N-[6-[(4-methoxy-3-nitro-benzoyl)amino]-1,3-benzothiazol-2-yl]-2-furamide Formula: C20H14N4O6S MolecularWeight: 438.41336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)NC(=O)C4=CC=CO4)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)NC(=O)C4=CC=CO4)[N+](=O)[O-]

InChI

InChI=1S/C20H14N4O6S/c1-29-15-7-4-11(9-14(15)24(27)28)18(25)21-12-5-6-13-17(10-12)31-20(22-13)23-19(26)16-3-2-8-30-16/h2-10H,1H3,(H,21,25)(H,22,23,26)