N-(3-nitrophenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)propanamide

Systemtic Name: N-(3-nitrophenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)propanamide Openeye Name: N-(3-nitrophenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)propanamide CAS Name: N-(3-nitrophenyl)-2-(1H-1,2,4-triazol-5-ylthio)propanamide IUPAC Name: N-(3-nitrophenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)propanamide Traditional Name: N-(3-nitrophenyl)-2-(1H-1,2,4-triazol-5-ylthio)propionamide Formula: C11H11N5O3S MolecularWeight: 293.30174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])SC2=NC=NN2

Isomeric SMILES

CC(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])SC2=NC=NN2

InChI

InChI=1S/C11H11N5O3S/c1-7(20-11-12-6-13-15-11)10(17)14-8-3-2-4-9(5-8)16(18)19/h2-7H,1H3,(H,14,17)(H,12,13,15)