2-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-N-(3-nitrophenyl)benzamide

Systemtic Name: 2-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-N-(3-nitrophenyl)benzamide Openeye Name: 2-[2-(2-furylmethylamino)-2-oxo-ethyl]sulfanyl-N-(3-nitrophenyl)benzamide CAS Name: 2-[[2-(2-furanylmethylamino)-2-oxoethyl]thio]-N-(3-nitrophenyl)benzamide IUPAC Name: 2-[2-(furan-2-ylmethylamino)-2-oxoethyl]sulfanyl-N-(3-nitrophenyl)benzamide Traditional Name: 2-[[2-(2-furfurylamino)-2-keto-ethyl]thio]-N-(3-nitrophenyl)benzamide Formula: C20H17N3O5S MolecularWeight: 411.43108

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=CC(=CC=C2)[N+](=O)[O-])SCC(=O)NCC3=CC=CO3

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=CC(=CC=C2)[N+](=O)[O-])SCC(=O)NCC3=CC=CO3

InChI

InChI=1S/C20H17N3O5S/c24-19(21-12-16-7-4-10-28-16)13-29-18-9-2-1-8-17(18)20(25)22-14-5-3-6-15(11-14)23(26)27/h1-11H,12-13H2,(H,21,24)(H,22,25)