propyl 2-[[5-(5-nitrothiophen-2-yl)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate

Systemtic Name: propyl 2-[[5-(5-nitrothiophen-2-yl)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate Openeye Name: propyl 2-[[5-(5-nitro-2-thienyl)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate CAS Name: 2-[[5-(5-nitro-2-thiophenyl)-1,3,4-thiadiazol-2-yl]thio]acetic acid propyl ester IUPAC Name: propyl 2-[[5-(5-nitrothiophen-2-yl)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate Traditional Name: 2-[[5-(5-nitro-2-thienyl)-1,3,4-thiadiazol-2-yl]thio]acetic acid propyl ester Formula: C11H11N3O4S3 MolecularWeight: 345.41774

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CSC1=NN=C(S1)C2=CC=C(S2)[N+](=O)[O-]

Isomeric SMILES

CCCOC(=O)CSC1=NN=C(S1)C2=CC=C(S2)[N+](=O)[O-]

InChI

InChI=1S/C11H11N3O4S3/c1-2-5-18-9(15)6-19-11-13-12-10(21-11)7-3-4-8(20-7)14(16)17/h3-4H,2,5-6H2,1H3