ethyl 5-[4-[2-oxidanyl-3-(propan-2-ylamino)propoxy]phenyl]-1,2,3-thiadiazole-4-carboxylate

Systemtic Name: ethyl 5-[4-[2-oxidanyl-3-(propan-2-ylamino)propoxy]phenyl]-1,2,3-thiadiazole-4-carboxylate Openeye Name: ethyl 5-[4-[2-hydroxy-3-(isopropylamino)propoxy]phenyl]thiadiazole-4-carboxylate CAS Name: 5-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]-4-thiadiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]thiadiazole-4-carboxylate Traditional Name: 5-[4-[2-hydroxy-3-(isopropylamino)propoxy]phenyl]thiadiazole-4-carboxylic acid ethyl ester Formula: C17H23N3O4S MolecularWeight: 365.44722

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SN=N1)C2=CC=C(C=C2)OCC(CNC(C)C)O

Isomeric SMILES

CCOC(=O)C1=C(SN=N1)C2=CC=C(C=C2)OCC(CNC(C)C)O

InChI

InChI=1S/C17H23N3O4S/c1-4-23-17(22)15-16(25-20-19-15)12-5-7-14(8-6-12)24-10-13(21)9-18-11(2)3/h5-8,11,13,18,21H,4,9-10H2,1-3H3