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

Systemtic Name: N-[6-[(4-chloranyl-3-nitro-phenyl)carbonylamino]-1,3-benzothiazol-2-yl]furan-2-carboxamide Openeye Name: N-[6-[(4-chloro-3-nitro-benzoyl)amino]-1,3-benzothiazol-2-yl]furan-2-carboxamide CAS Name: N-[6-[[(4-chloro-3-nitrophenyl)-oxomethyl]amino]-1,3-benzothiazol-2-yl]-2-furancarboxamide IUPAC Name: N-[6-[(4-chloro-3-nitrobenzoyl)amino]-1,3-benzothiazol-2-yl]furan-2-carboxamide Traditional Name: N-[6-[(4-chloro-3-nitro-benzoyl)amino]-1,3-benzothiazol-2-yl]-2-furamide Formula: C19H11ClN4O5S MolecularWeight: 442.83244

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=COC(=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H11ClN4O5S/c20-12-5-3-10(8-14(12)24(27)28)17(25)21-11-4-6-13-16(9-11)30-19(22-13)23-18(26)15-2-1-7-29-15/h1-9H,(H,21,25)(H,22,23,26)