(2S)-2-(butanoylamino)-3-(triphenylmethyl)sulfanyl-propanoic acid

Systemtic Name: (2S)-2-(butanoylamino)-3-(triphenylmethyl)sulfanyl-propanoic acid Openeye Name: (2S)-2-(butanoylamino)-3-tritylsulfanyl-propanoic acid CAS Name: (2S)-2-(1-oxobutylamino)-3-[(triphenylmethyl)thio]propanoic acid IUPAC Name: (2S)-2-(butanoylamino)-3-tritylsulfanylpropanoic acid Traditional Name: (2S)-2-butyramido-3-(tritylthio)propionic acid Formula: C26H27NO3S MolecularWeight: 433.56248

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC(CSC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCCC(=O)N[C@H](CSC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C26H27NO3S/c1-2-12-24(28)27-23(25(29)30)19-31-26(20-13-6-3-7-14-20,21-15-8-4-9-16-21)22-17-10-5-11-18-22/h3-11,13-18,23H,2,12,19H2,1H3,(H,27,28)(H,29,30)/t23-/m1/s1