5-(3-nitrophenyl)-N-[(2-phenylbenzotriazol-5-yl)carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-(3-nitrophenyl)-N-[(2-phenylbenzotriazol-5-yl)carbamothioyl]furan-2-carboxamide Openeye Name: 5-(3-nitrophenyl)-N-[(2-phenylbenzotriazol-5-yl)carbamothioyl]furan-2-carboxamide CAS Name: 5-(3-nitrophenyl)-N-[[(2-phenyl-5-benzotriazolyl)amino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-(3-nitrophenyl)-N-[(2-phenylbenzotriazol-5-yl)carbamothioyl]furan-2-carboxamide Traditional Name: 5-(3-nitrophenyl)-N-[(2-phenylbenzotriazol-5-yl)thiocarbamoyl]-2-furamide Formula: C24H16N6O4S MolecularWeight: 484.48664

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=S)NC(=O)C4=CC=C(O4)C5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=S)NC(=O)C4=CC=C(O4)C5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C24H16N6O4S/c31-23(22-12-11-21(34-22)15-5-4-8-18(13-15)30(32)33)26-24(35)25-16-9-10-19-20(14-16)28-29(27-19)17-6-2-1-3-7-17/h1-14H,(H2,25,26,31,35)