methyl 2-[2-(2-aminophenyl)sulfanylethanoylamino]-4-methyl-pentanoate

Systemtic Name: methyl 2-[2-(2-aminophenyl)sulfanylethanoylamino]-4-methyl-pentanoate Openeye Name: methyl 2-[[2-(2-aminophenyl)sulfanylacetyl]amino]-4-methyl-pentanoate CAS Name: 2-[[2-[(2-aminophenyl)thio]-1-oxoethyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[[2-(2-aminophenyl)sulfanylacetyl]amino]-4-methylpentanoate Traditional Name: 2-[[2-[(2-aminophenyl)thio]acetyl]amino]-4-methyl-valeric acid methyl ester Formula: C15H22N2O3S MolecularWeight: 310.41178

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)CSC1=CC=CC=C1N

Isomeric SMILES

CC(C)CC(C(=O)OC)NC(=O)CSC1=CC=CC=C1N

InChI

InChI=1S/C15H22N2O3S/c1-10(2)8-12(15(19)20-3)17-14(18)9-21-13-7-5-4-6-11(13)16/h4-7,10,12H,8-9,16H2,1-3H3,(H,17,18)