3-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methoxy-4-nitro-phenyl)propanamide

Systemtic Name: 3-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methoxy-4-nitro-phenyl)propanamide Openeye Name: 3-[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methoxy-4-nitro-phenyl)propanamide CAS Name: 3-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-N-(2-methoxy-4-nitrophenyl)propanamide IUPAC Name: 3-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methoxy-4-nitrophenyl)propanamide Traditional Name: 3-[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]-N-(2-methoxy-4-nitro-phenyl)propionamide Formula: C18H19N5O4S2 MolecularWeight: 433.50456

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCCC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])OC)C3=CC=CS3

Isomeric SMILES

CCN1C(=NN=C1SCCC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])OC)C3=CC=CS3

InChI

InChI=1S/C18H19N5O4S2/c1-3-22-17(15-5-4-9-28-15)20-21-18(22)29-10-8-16(24)19-13-7-6-12(23(25)26)11-14(13)27-2/h4-7,9,11H,3,8,10H2,1-2H3,(H,19,24)