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

Systemtic Name: propyl 2-[[5-(1-methyl-5-nitro-imidazol-2-yl)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate Openeye Name: propyl 2-[[5-(1-methyl-5-nitro-imidazol-2-yl)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate CAS Name: 2-[[5-(1-methyl-5-nitro-2-imidazolyl)-1,3,4-thiadiazol-2-yl]thio]acetic acid propyl ester IUPAC Name: propyl 2-[[5-(1-methyl-5-nitroimidazol-2-yl)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate Traditional Name: 2-[[5-(1-methyl-5-nitro-imidazol-2-yl)-1,3,4-thiadiazol-2-yl]thio]acetic acid propyl ester Formula: C11H13N5O4S2 MolecularWeight: 343.38202

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CSC1=NN=C(S1)C2=NC=C(N2C)[N+](=O)[O-]

Isomeric SMILES

CCCOC(=O)CSC1=NN=C(S1)C2=NC=C(N2C)[N+](=O)[O-]

InChI

InChI=1S/C11H13N5O4S2/c1-3-4-20-8(17)6-21-11-14-13-10(22-11)9-12-5-7(15(9)2)16(18)19/h5H,3-4,6H2,1-2H3