[1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 3-phenylsulfanylpropanoate

Systemtic Name: [1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 3-phenylsulfanylpropanoate Openeye Name: (1-allophanoyl-2-methyl-propyl) 3-phenylsulfanylpropanoate CAS Name: 3-(phenylthio)propanoic acid [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] 3-phenylsulfanylpropanoate Traditional Name: 3-(phenylthio)propionic acid (1-allophanoyl-2-methyl-propyl) ester Formula: C15H20N2O4S MolecularWeight: 324.3953

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(=O)N)OC(=O)CCSC1=CC=CC=C1

Isomeric SMILES

CC(C)C(C(=O)NC(=O)N)OC(=O)CCSC1=CC=CC=C1

InChI

InChI=1S/C15H20N2O4S/c1-10(2)13(14(19)17-15(16)20)21-12(18)8-9-22-11-6-4-3-5-7-11/h3-7,10,13H,8-9H2,1-2H3,(H3,16,17,19,20)