methyl (2S)-2-[(5-azanylnaphthalen-1-yl)carbonyl-methyl-amino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl (2S)-2-[(5-azanylnaphthalen-1-yl)carbonyl-methyl-amino]-4-methylsulfanyl-butanoate Openeye Name: methyl (2S)-2-[(5-aminonaphthalene-1-carbonyl)-methyl-amino]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[(5-amino-1-naphthalenyl)-oxomethyl]-methylamino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(5-aminonaphthalene-1-carbonyl)-methylamino]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[(5-amino-1-naphthoyl)-methyl-amino]-4-(methylthio)butyric acid methyl ester Formula: C18H22N2O3S MolecularWeight: 346.44388

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(CCSC)C(=O)OC)C(=O)C1=CC=CC2=C1C=CC=C2N

Isomeric SMILES

CN([C@@H](CCSC)C(=O)OC)C(=O)C1=CC=CC2=C1C=CC=C2N

InChI

InChI=1S/C18H22N2O3S/c1-20(16(10-11-24-3)18(22)23-2)17(21)14-8-4-7-13-12(14)6-5-9-15(13)19/h4-9,16H,10-11,19H2,1-3H3/t16-/m0/s1