ethyl 2-[2-[[5-(propylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoylamino]benzoate

Systemtic Name: ethyl 2-[2-[[5-(propylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoylamino]benzoate Openeye Name: ethyl 2-[[2-[[5-(propylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]benzoate CAS Name: 2-[[1-oxo-2-[[5-(propylamino)-1,3,4-thiadiazol-2-yl]thio]ethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[2-[[5-(propylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]benzoate Traditional Name: 2-[[2-[[5-(propylamino)-1,3,4-thiadiazol-2-yl]thio]acetyl]amino]benzoic acid ethyl ester Formula: C16H20N4O3S2 MolecularWeight: 380.485

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=NN=C(S1)SCC(=O)NC2=CC=CC=C2C(=O)OCC

Isomeric SMILES

CCCNC1=NN=C(S1)SCC(=O)NC2=CC=CC=C2C(=O)OCC

InChI

InChI=1S/C16H20N4O3S2/c1-3-9-17-15-19-20-16(25-15)24-10-13(21)18-12-8-6-5-7-11(12)14(22)23-4-2/h5-8H,3-4,9-10H2,1-2H3,(H,17,19)(H,18,21)