ethyl 3-[[3-(4-methylsulfanylphenyl)carbonylpiperidin-1-yl]carbonylamino]propanoate

Systemtic Name: ethyl 3-[[3-(4-methylsulfanylphenyl)carbonylpiperidin-1-yl]carbonylamino]propanoate Openeye Name: ethyl 3-[[3-(4-methylsulfanylbenzoyl)piperidine-1-carbonyl]amino]propanoate CAS Name: 3-[[[3-[[4-(methylthio)phenyl]-oxomethyl]-1-piperidinyl]-oxomethyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[[3-(4-methylsulfanylbenzoyl)piperidine-1-carbonyl]amino]propanoate Traditional Name: 3-[[3-[4-(methylthio)benzoyl]piperidine-1-carbonyl]amino]propionic acid ethyl ester Formula: C19H26N2O4S MolecularWeight: 378.48574

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCNC(=O)N1CCCC(C1)C(=O)C2=CC=C(C=C2)SC

Isomeric SMILES

CCOC(=O)CCNC(=O)N1CCCC(C1)C(=O)C2=CC=C(C=C2)SC

InChI

InChI=1S/C19H26N2O4S/c1-3-25-17(22)10-11-20-19(24)21-12-4-5-15(13-21)18(23)14-6-8-16(26-2)9-7-14/h6-9,15H,3-5,10-13H2,1-2H3,(H,20,24)