2-[[5-(2,4-dinitrophenyl)sulfanyl-1,3,4-thiadiazol-2-yl]sulfanyl]-N-propyl-ethanamide

Systemtic Name: 2-[[5-(2,4-dinitrophenyl)sulfanyl-1,3,4-thiadiazol-2-yl]sulfanyl]-N-propyl-ethanamide Openeye Name: 2-[[5-(2,4-dinitrophenyl)sulfanyl-1,3,4-thiadiazol-2-yl]sulfanyl]-N-propyl-acetamide CAS Name: 2-[[5-[(2,4-dinitrophenyl)thio]-1,3,4-thiadiazol-2-yl]thio]-N-propylacetamide IUPAC Name: 2-[[5-(2,4-dinitrophenyl)sulfanyl-1,3,4-thiadiazol-2-yl]sulfanyl]-N-propylacetamide Traditional Name: 2-[[5-[(2,4-dinitrophenyl)thio]-1,3,4-thiadiazol-2-yl]thio]-N-propyl-acetamide Formula: C13H13N5O5S3 MolecularWeight: 415.46782

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CSC1=NN=C(S1)SC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCNC(=O)CSC1=NN=C(S1)SC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H13N5O5S3/c1-2-5-14-11(19)7-24-12-15-16-13(26-12)25-10-4-3-8(17(20)21)6-9(10)18(22)23/h3-4,6H,2,5,7H2,1H3,(H,14,19)