[2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl] 3-(aminocarbonylamino)propanoate

Systemtic Name: [2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl] 3-(aminocarbonylamino)propanoate Openeye Name: [2-oxo-2-(3-phenylsulfanylpropylamino)ethyl] 3-ureidopropanoate CAS Name: 3-(carbamoylamino)propanoic acid [2-oxo-2-[3-(phenylthio)propylamino]ethyl] ester IUPAC Name: [2-oxo-2-(3-phenylsulfanylpropylamino)ethyl] 3-(carbamoylamino)propanoate Traditional Name: 3-ureidopropionic acid [2-keto-2-[3-(phenylthio)propylamino]ethyl] ester Formula: C15H21N3O4S MolecularWeight: 339.40994

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCCNC(=O)COC(=O)CCNC(=O)N

Isomeric SMILES

C1=CC=C(C=C1)SCCCNC(=O)COC(=O)CCNC(=O)N

InChI

InChI=1S/C15H21N3O4S/c16-15(21)18-9-7-14(20)22-11-13(19)17-8-4-10-23-12-5-2-1-3-6-12/h1-3,5-6H,4,7-11H2,(H,17,19)(H3,16,18,21)