1-[4-ethoxy-3-[[5-(3-ethoxypropylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]phenyl]ethanone

Systemtic Name: 1-[4-ethoxy-3-[[5-(3-ethoxypropylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]phenyl]ethanone Openeye Name: 1-[4-ethoxy-3-[[5-(3-ethoxypropylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]phenyl]ethanone CAS Name: 1-[4-ethoxy-3-[[[5-(3-ethoxypropylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]phenyl]ethanone IUPAC Name: 1-[4-ethoxy-3-[[5-(3-ethoxypropylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]phenyl]ethanone Traditional Name: 1-[4-ethoxy-3-[[[5-(3-ethoxypropylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]phenyl]ethanone Formula: C18H25N3O3S2 MolecularWeight: 395.5394

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC1=NN=C(S1)SCC2=C(C=CC(=C2)C(=O)C)OCC

Isomeric SMILES

CCOCCCNC1=NN=C(S1)SCC2=C(C=CC(=C2)C(=O)C)OCC

InChI

InChI=1S/C18H25N3O3S2/c1-4-23-10-6-9-19-17-20-21-18(26-17)25-12-15-11-14(13(3)22)7-8-16(15)24-5-2/h7-8,11H,4-6,9-10,12H2,1-3H3,(H,19,20)