(4-methylsulfanylphenyl)methyl 6-(aminocarbonylamino)hexanoate

Systemtic Name: (4-methylsulfanylphenyl)methyl 6-(aminocarbonylamino)hexanoate Openeye Name: (4-methylsulfanylphenyl)methyl 6-ureidohexanoate CAS Name: 6-(carbamoylamino)hexanoic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl 6-(carbamoylamino)hexanoate Traditional Name: 6-ureidohexanoic acid [4-(methylthio)benzyl] ester Formula: C15H22N2O3S MolecularWeight: 310.41178

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)COC(=O)CCCCCNC(=O)N

Isomeric SMILES

CSC1=CC=C(C=C1)COC(=O)CCCCCNC(=O)N

InChI

InChI=1S/C15H22N2O3S/c1-21-13-8-6-12(7-9-13)11-20-14(18)5-3-2-4-10-17-15(16)19/h6-9H,2-5,10-11H2,1H3,(H3,16,17,19)