2-[2-(2,3-dihydro-1H-inden-5-ylsulfanyl)ethanoylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[2-(2,3-dihydro-1H-inden-5-ylsulfanyl)ethanoylamino]-3-methyl-butanoic acid Openeye Name: 2-[(2-indan-5-ylsulfanylacetyl)amino]-3-methyl-butanoic acid CAS Name: 2-[[2-(2,3-dihydro-1H-inden-5-ylthio)-1-oxoethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[2-(2,3-dihydro-1H-inden-5-ylsulfanyl)acetyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[2-(indan-5-ylthio)acetyl]amino]-3-methyl-butyric acid Formula: C16H21NO3S MolecularWeight: 307.40784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)CSC1=CC2=C(CCC2)C=C1

Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)CSC1=CC2=C(CCC2)C=C1

InChI

InChI=1S/C16H21NO3S/c1-10(2)15(16(19)20)17-14(18)9-21-13-7-6-11-4-3-5-12(11)8-13/h6-8,10,15H,3-5,9H2,1-2H3,(H,17,18)(H,19,20)