4-azanyl-6-[[5-(4-nitrophenyl)furan-2-yl]methyl]-3-sulfanylidene-2H-1,2,4-triazin-5-one

Systemtic Name: 4-azanyl-6-[[5-(4-nitrophenyl)furan-2-yl]methyl]-3-sulfanylidene-2H-1,2,4-triazin-5-one Openeye Name: 4-amino-6-[[5-(4-nitrophenyl)-2-furyl]methyl]-3-thioxo-2H-1,2,4-triazin-5-one CAS Name: 4-amino-6-[[5-(4-nitrophenyl)-2-furanyl]methyl]-3-sulfanylidene-2H-1,2,4-triazin-5-one IUPAC Name: 4-amino-6-[[5-(4-nitrophenyl)furan-2-yl]methyl]-3-sulfanylidene-2H-1,2,4-triazin-5-one Traditional Name: 4-amino-6-[[5-(4-nitrophenyl)-2-furyl]methyl]-3-thioxo-2H-1,2,4-triazin-5-one Formula: C14H11N5O4S MolecularWeight: 345.33324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=C(O2)CC3=NNC(=S)N(C3=O)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=CC=C(O2)CC3=NNC(=S)N(C3=O)N)[N+](=O)[O-]

InChI

InChI=1S/C14H11N5O4S/c15-18-13(20)11(16-17-14(18)24)7-10-5-6-12(23-10)8-1-3-9(4-2-8)19(21)22/h1-6H,7,15H2,(H,17,24)