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

Systemtic Name: N-[6-[(3-nitro-4-piperidin-1-yl-phenyl)carbonylamino]-1,3-benzothiazol-2-yl]furan-2-carboxamide Openeye Name: N-[6-[[3-nitro-4-(1-piperidyl)benzoyl]amino]-1,3-benzothiazol-2-yl]furan-2-carboxamide CAS Name: N-[6-[[[3-nitro-4-(1-piperidinyl)phenyl]-oxomethyl]amino]-1,3-benzothiazol-2-yl]-2-furancarboxamide IUPAC Name: N-[6-[(3-nitro-4-piperidin-1-ylbenzoyl)amino]-1,3-benzothiazol-2-yl]furan-2-carboxamide Traditional Name: N-[6-[(3-nitro-4-piperidino-benzoyl)amino]-1,3-benzothiazol-2-yl]-2-furamide Formula: C24H21N5O5S MolecularWeight: 491.51904

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC4=C(C=C3)N=C(S4)NC(=O)C5=CC=CO5)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC4=C(C=C3)N=C(S4)NC(=O)C5=CC=CO5)[N+](=O)[O-]

InChI

InChI=1S/C24H21N5O5S/c30-22(15-6-9-18(19(13-15)29(32)33)28-10-2-1-3-11-28)25-16-7-8-17-21(14-16)35-24(26-17)27-23(31)20-5-4-12-34-20/h4-9,12-14H,1-3,10-11H2,(H,25,30)(H,26,27,31)