5-(3-nitrophenyl)-N-[(2-pyridin-3-yl-1,3-benzoxazol-5-yl)carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-(3-nitrophenyl)-N-[(2-pyridin-3-yl-1,3-benzoxazol-5-yl)carbamothioyl]furan-2-carboxamide Openeye Name: 5-(3-nitrophenyl)-N-[[2-(3-pyridyl)-1,3-benzoxazol-5-yl]carbamothioyl]furan-2-carboxamide CAS Name: 5-(3-nitrophenyl)-N-[[[2-(3-pyridinyl)-1,3-benzoxazol-5-yl]amino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-(3-nitrophenyl)-N-[(2-pyridin-3-yl-1,3-benzoxazol-5-yl)carbamothioyl]furan-2-carboxamide Traditional Name: 5-(3-nitrophenyl)-N-[[2-(3-pyridyl)-1,3-benzoxazol-5-yl]thiocarbamoyl]-2-furamide Formula: C24H15N5O5S MolecularWeight: 485.4714

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC=C(O2)C(=O)NC(=S)NC3=CC4=C(C=C3)OC(=N4)C5=CN=CC=C5

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC=C(O2)C(=O)NC(=S)NC3=CC4=C(C=C3)OC(=N4)C5=CN=CC=C5

InChI

InChI=1S/C24H15N5O5S/c30-22(21-9-8-19(33-21)14-3-1-5-17(11-14)29(31)32)28-24(35)26-16-6-7-20-18(12-16)27-23(34-20)15-4-2-10-25-13-15/h1-13H,(H2,26,28,30,35)