tert-butyl 2-[[2-[[2-azanyl-3-(triphenylmethyl)sulfanyl-propanoyl]amino]-3-phenyl-propanoyl]amino]ethanoate

Systemtic Name: tert-butyl 2-[[2-[[2-azanyl-3-(triphenylmethyl)sulfanyl-propanoyl]amino]-3-phenyl-propanoyl]amino]ethanoate Openeye Name: tert-butyl 2-[[2-[(2-amino-3-tritylsulfanyl-propanoyl)amino]-3-phenyl-propanoyl]amino]acetate CAS Name: 2-[[2-[[2-amino-1-oxo-3-[(triphenylmethyl)thio]propyl]amino]-1-oxo-3-phenylpropyl]amino]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[2-[(2-amino-3-tritylsulfanylpropanoyl)amino]-3-phenylpropanoyl]amino]acetate Traditional Name: 2-[[2-[[2-amino-3-(tritylthio)propanoyl]amino]-3-phenyl-propanoyl]amino]acetic acid tert-butyl ester Formula: C37H41N3O4S MolecularWeight: 623.80414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CNC(=O)C(CC1=CC=CC=C1)NC(=O)C(CSC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)N

Isomeric SMILES

CC(C)(C)OC(=O)CNC(=O)C(CC1=CC=CC=C1)NC(=O)C(CSC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)N

InChI

InChI=1S/C37H41N3O4S/c1-36(2,3)44-33(41)25-39-35(43)32(24-27-16-8-4-9-17-27)40-34(42)31(38)26-45-37(28-18-10-5-11-19-28,29-20-12-6-13-21-29)30-22-14-7-15-23-30/h4-23,31-32H,24-26,38H2,1-3H3,(H,39,43)(H,40,42)