N-(1,3-benzothiazol-2-yl)-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]cyclohexanecarboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]cyclohexanecarboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-[(E)-(5-nitro-2-furyl)methyleneamino]cyclohexanecarboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-[(E)-(5-nitro-2-furanyl)methylideneamino]cyclohexanecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]cyclohexanecarboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-[(E)-(5-nitro-2-furyl)methyleneamino]cyclohexanecarboxamide Formula: C19H18N4O4S MolecularWeight: 398.43562

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N(C2=NC3=CC=CC=C3S2)N=CC4=CC=C(O4)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)C(=O)N(C2=NC3=CC=CC=C3S2)/N=C/C4=CC=C(O4)[N+](=O)[O-]

InChI

InChI=1S/C19H18N4O4S/c24-18(13-6-2-1-3-7-13)22(19-21-15-8-4-5-9-16(15)28-19)20-12-14-10-11-17(27-14)23(25)26/h4-5,8-13H,1-3,6-7H2/b20-12+