butyl 2-[[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate

Systemtic Name: butyl 2-[[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate Openeye Name: butyl 2-[[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate CAS Name: 2-[[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]thio]acetic acid butyl ester IUPAC Name: butyl 2-[[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate Traditional Name: 2-[[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]thio]acetic acid butyl ester Formula: C16H21N3O2S2 MolecularWeight: 351.48684

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CSC1=NN=C(S1)NCCC2=CC=CC=C2

Isomeric SMILES

CCCCOC(=O)CSC1=NN=C(S1)NCCC2=CC=CC=C2

InChI

InChI=1S/C16H21N3O2S2/c1-2-3-11-21-14(20)12-22-16-19-18-15(23-16)17-10-9-13-7-5-4-6-8-13/h4-8H,2-3,9-12H2,1H3,(H,17,18)