(phenylmethyl) 3-phenyl-3-[2-[(triphenylmethyl)amino]ethylsulfanylcarbonylamino]propanoate

Systemtic Name: (phenylmethyl) 3-phenyl-3-[2-[(triphenylmethyl)amino]ethylsulfanylcarbonylamino]propanoate Openeye Name: benzyl 3-phenyl-3-[2-(tritylamino)ethylsulfanylcarbonylamino]propanoate CAS Name: 3-[[oxo-[2-[(triphenylmethyl)amino]ethylthio]methyl]amino]-3-phenylpropanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-phenyl-3-[2-(tritylamino)ethylsulfanylcarbonylamino]propanoate Traditional Name: 3-phenyl-3-[[2-(tritylamino)ethylthio]carbonylamino]propionic acid benzyl ester Formula: C38H36N2O3S MolecularWeight: 600.76904

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CC(C2=CC=CC=C2)NC(=O)SCCNC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CC(C2=CC=CC=C2)NC(=O)SCCNC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C38H36N2O3S/c41-36(43-29-30-16-6-1-7-17-30)28-35(31-18-8-2-9-19-31)40-37(42)44-27-26-39-38(32-20-10-3-11-21-32,33-22-12-4-13-23-33)34-24-14-5-15-25-34/h1-25,35,39H,26-29H2,(H,40,42)