tert-butyl 2-[4-(2-azanylethyl)phenyl]sulfanyl-2-methyl-propanoate

Systemtic Name: tert-butyl 2-[4-(2-azanylethyl)phenyl]sulfanyl-2-methyl-propanoate Openeye Name: tert-butyl 2-[4-(2-aminoethyl)phenyl]sulfanyl-2-methyl-propanoate CAS Name: 2-[[4-(2-aminoethyl)phenyl]thio]-2-methylpropanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-(2-aminoethyl)phenyl]sulfanyl-2-methylpropanoate Traditional Name: 2-[[4-(2-aminoethyl)phenyl]thio]-2-methyl-propionic acid tert-butyl ester Formula: C16H25NO2S MolecularWeight: 295.4402

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(C)(C)SC1=CC=C(C=C1)CCN

Isomeric SMILES

CC(C)(C)OC(=O)C(C)(C)SC1=CC=C(C=C1)CCN

InChI

InChI=1S/C16H25NO2S/c1-15(2,3)19-14(18)16(4,5)20-13-8-6-12(7-9-13)10-11-17/h6-9H,10-11,17H2,1-5H3