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

Systemtic Name: N-[6-[(4-ethoxy-3-nitro-phenyl)carbonylamino]-1,3-benzothiazol-2-yl]furan-2-carboxamide Openeye Name: N-[6-[(4-ethoxy-3-nitro-benzoyl)amino]-1,3-benzothiazol-2-yl]furan-2-carboxamide CAS Name: N-[6-[[(4-ethoxy-3-nitrophenyl)-oxomethyl]amino]-1,3-benzothiazol-2-yl]-2-furancarboxamide IUPAC Name: N-[6-[(4-ethoxy-3-nitrobenzoyl)amino]-1,3-benzothiazol-2-yl]furan-2-carboxamide Traditional Name: N-[6-[(4-ethoxy-3-nitro-benzoyl)amino]-1,3-benzothiazol-2-yl]-2-furamide Formula: C21H16N4O6S MolecularWeight: 452.43994

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=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

CCOC1=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/C21H16N4O6S/c1-2-30-16-8-5-12(10-15(16)25(28)29)19(26)22-13-6-7-14-18(11-13)32-21(23-14)24-20(27)17-4-3-9-31-17/h3-11H,2H2,1H3,(H,22,26)(H,23,24,27)