(2R)-2-azanyl-N-(phenylmethyl)-3-(triphenylmethyl)sulfanyl-propanamide; (E)-but-2-enedioic acid

Systemtic Name: (2R)-2-azanyl-N-(phenylmethyl)-3-(triphenylmethyl)sulfanyl-propanamide; (E)-but-2-enedioic acid Openeye Name: (2R)-2-amino-N-benzyl-3-tritylsulfanyl-propanamide; fumaric acid CAS Name: (2R)-2-amino-N-(phenylmethyl)-3-[(triphenylmethyl)thio]propanamide; (E)-2-butenedioic acid IUPAC Name: (2R)-2-amino-N-benzyl-3-tritylsulfanylpropanamide; (E)-but-2-enedioic acid Traditional Name: (2R)-2-amino-N-benzyl-3-(tritylthio)propionamide; fumaric acid Formula: C33H32N2O5S MolecularWeight: 568.68258

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C(CSC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)N.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)[C@H](CSC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)N.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C29H28N2OS.C4H4O4/c30-27(28(32)31-21-23-13-5-1-6-14-23)22-33-29(24-15-7-2-8-16-24,25-17-9-3-10-18-25)26-19-11-4-12-20-26;5-3(6)1-2-4(7)8/h1-20,27H,21-22,30H2,(H,31,32);1-2H,(H,5,6)(H,7,8)/b;2-1+/t27-;/m0./s1