azanyl 2-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propylsulfanyl]-3-oxidanylidene-2-(1H-1,2,4-triazol-5-yl)propanoate

Systemtic Name: azanyl 2-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propylsulfanyl]-3-oxidanylidene-2-(1H-1,2,4-triazol-5-yl)propanoate Openeye Name: amino 2-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propylsulfanyl]-3-oxo-2-(1H-1,2,4-triazol-5-yl)propanoate CAS Name: 2-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propylthio]-3-oxo-2-(1H-1,2,4-triazol-5-yl)propanoic acid amino ester IUPAC Name: amino 2-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propylsulfanyl]-3-oxo-2-(1H-1,2,4-triazol-5-yl)propanoate Traditional Name: 2-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propylthio]-3-keto-2-(1H-1,2,4-triazol-5-yl)propionic acid amino ester Formula: C19H24N4O6S MolecularWeight: 436.48206

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCSC(C=O)(C2=NC=NN2)C(=O)ON

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCSC(C=O)(C2=NC=NN2)C(=O)ON

InChI

InChI=1S/C19H24N4O6S/c1-3-5-14-15(7-6-13(12(2)25)16(14)26)28-8-4-9-30-19(10-24,18(27)29-20)17-21-11-22-23-17/h6-7,10-11,26H,3-5,8-9,20H2,1-2H3,(H,21,22,23)