(2S)-2-[(4-tert-butylphenyl)carbonylamino]-3-sulfanyl-propanoic acid

Systemtic Name: (2S)-2-[(4-tert-butylphenyl)carbonylamino]-3-sulfanyl-propanoic acid Openeye Name: (2S)-2-[(4-tert-butylbenzoyl)amino]-3-sulfanyl-propanoic acid CAS Name: (2S)-2-[[(4-tert-butylphenyl)-oxomethyl]amino]-3-mercaptopropanoic acid IUPAC Name: (2S)-2-[(4-tert-butylbenzoyl)amino]-3-sulfanylpropanoic acid Traditional Name: (2S)-2-[(4-tert-butylbenzoyl)amino]-3-mercapto-propionic acid Formula: C14H19NO3S MolecularWeight: 281.37056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(CS)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N[C@H](CS)C(=O)O

InChI

InChI=1S/C14H19NO3S/c1-14(2,3)10-6-4-9(5-7-10)12(16)15-11(8-19)13(17)18/h4-7,11,19H,8H2,1-3H3,(H,15,16)(H,17,18)/t11-/m1/s1