methyl 2-[(2-azanyl-4-methylsulfanyl-butanoyl)amino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[(2-azanyl-4-methylsulfanyl-butanoyl)amino]-3-phenyl-propanoate Openeye Name: methyl 2-[(2-amino-4-methylsulfanyl-butanoyl)amino]-3-phenyl-propanoate CAS Name: 2-[[2-amino-4-(methylthio)-1-oxobutyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[(2-amino-4-methylsulfanylbutanoyl)amino]-3-phenylpropanoate Traditional Name: 2-[[2-amino-4-(methylthio)butanoyl]amino]-3-phenyl-propionic acid methyl ester Formula: C15H22N2O3S MolecularWeight: 310.41178

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)C(CCSC)N

Isomeric SMILES

COC(=O)C(CC1=CC=CC=C1)NC(=O)C(CCSC)N

InChI

InChI=1S/C15H22N2O3S/c1-20-15(19)13(10-11-6-4-3-5-7-11)17-14(18)12(16)8-9-21-2/h3-7,12-13H,8-10,16H2,1-2H3,(H,17,18)