N-(furan-2-ylmethyl)-4-[[5-(4-nitrophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]butanamide

Systemtic Name: N-(furan-2-ylmethyl)-4-[[5-(4-nitrophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]butanamide Openeye Name: N-(2-furylmethyl)-4-[[5-(4-nitrophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]butanamide CAS Name: N-(2-furanylmethyl)-4-[[5-(4-nitrophenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]butanamide IUPAC Name: N-(furan-2-ylmethyl)-4-[[5-(4-nitrophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]butanamide Traditional Name: N-(2-furfuryl)-4-[[5-(4-nitrophenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]butyramide Formula: C23H21N5O4S MolecularWeight: 463.50894

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=C2SCCCC(=O)NCC3=CC=CO3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=C2SCCCC(=O)NCC3=CC=CO3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H21N5O4S/c29-21(24-16-20-8-4-14-32-20)9-5-15-33-23-26-25-22(27(23)18-6-2-1-3-7-18)17-10-12-19(13-11-17)28(30)31/h1-4,6-8,10-14H,5,9,15-16H2,(H,24,29)