3-[(4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methyl-3-nitro-phenyl)propanamide

Systemtic Name: 3-[(4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methyl-3-nitro-phenyl)propanamide Openeye Name: 3-[(4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methyl-3-nitro-phenyl)propanamide CAS Name: 3-[(4-ethyl-1,2,4-triazol-3-yl)thio]-N-(2-methyl-3-nitrophenyl)propanamide IUPAC Name: 3-[(4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methyl-3-nitrophenyl)propanamide Traditional Name: 3-[(4-ethyl-1,2,4-triazol-3-yl)thio]-N-(2-methyl-3-nitro-phenyl)propionamide Formula: C14H17N5O3S MolecularWeight: 335.38148

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NN=C1SCCC(=O)NC2=C(C(=CC=C2)[N+](=O)[O-])C

Isomeric SMILES

CCN1C=NN=C1SCCC(=O)NC2=C(C(=CC=C2)[N+](=O)[O-])C

InChI

InChI=1S/C14H17N5O3S/c1-3-18-9-15-17-14(18)23-8-7-13(20)16-11-5-4-6-12(10(11)2)19(21)22/h4-6,9H,3,7-8H2,1-2H3,(H,16,20)