3-[[5-(furan-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-nitrophenyl)propanamide

Systemtic Name: 3-[[5-(furan-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-nitrophenyl)propanamide Openeye Name: 3-[[5-(2-furyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-nitrophenyl)propanamide CAS Name: 3-[[5-(2-furanyl)-4-methyl-1,2,4-triazol-3-yl]thio]-N-(2-nitrophenyl)propanamide IUPAC Name: 3-[[5-(furan-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-nitrophenyl)propanamide Traditional Name: 3-[[5-(2-furyl)-4-methyl-1,2,4-triazol-3-yl]thio]-N-(2-nitrophenyl)propionamide Formula: C16H15N5O4S MolecularWeight: 373.3864

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCCC(=O)NC2=CC=CC=C2[N+](=O)[O-])C3=CC=CO3

Isomeric SMILES

CN1C(=NN=C1SCCC(=O)NC2=CC=CC=C2[N+](=O)[O-])C3=CC=CO3

InChI

InChI=1S/C16H15N5O4S/c1-20-15(13-7-4-9-25-13)18-19-16(20)26-10-8-14(22)17-11-5-2-3-6-12(11)21(23)24/h2-7,9H,8,10H2,1H3,(H,17,22)