2-dimethylaminoethyl 2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]propanoate hydrochloride

Systemtic Name: 2-dimethylaminoethyl 2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]propanoate hydrochloride Openeye Name: 2-dimethylaminoethyl 2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]propanoate hydrochloride CAS Name: 2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylthio]propanoic acid 2-dimethylaminoethyl ester hydrochloride IUPAC Name: 2-dimethylaminoethyl 2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]propanoate hydrochloride Traditional Name: 2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylthio]propionic acid 2-dimethylaminoethyl ester hydrochloride Formula: C16H22ClN3O3S MolecularWeight: 371.88218

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCCN(C)C)SCC1=NC(=NO1)C2=CC=CC=C2.Cl

Isomeric SMILES

CC(C(=O)OCCN(C)C)SCC1=NC(=NO1)C2=CC=CC=C2.Cl

InChI

InChI=1S/C16H21N3O3S.ClH/c1-12(16(20)21-10-9-19(2)3)23-11-14-17-15(18-22-14)13-7-5-4-6-8-13;/h4-8,12H,9-11H2,1-3H3;1H