2-[2-methoxy-2-methyl-1-[(triphenylmethyl)sulfanylamino]pentyl]-5-oxidanylidene-2H-pyrrole-1-carboxylate

Systemtic Name: 2-[2-methoxy-2-methyl-1-[(triphenylmethyl)sulfanylamino]pentyl]-5-oxidanylidene-2H-pyrrole-1-carboxylate Openeye Name: 2-[2-methoxy-2-methyl-1-(tritylsulfanylamino)pentyl]-5-oxo-2H-pyrrole-1-carboxylate CAS Name: 2-[2-methoxy-2-methyl-1-[[(triphenylmethyl)thio]amino]pentyl]-5-oxo-2H-pyrrole-1-carboxylate IUPAC Name: 2-[2-methoxy-2-methyl-1-(tritylsulfanylamino)pentyl]-5-oxo-2H-pyrrole-1-carboxylate Traditional Name: 2-keto-5-[2-methoxy-2-methyl-1-[(tritylthio)amino]pentyl]-3-pyrroline-1-carboxylate Formula: C31H33N2O4S- MolecularWeight: 529.66972

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C(C1C=CC(=O)N1C(=O)[O-])NSC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)OC

Isomeric SMILES

CCCC(C)(C(C1C=CC(=O)N1C(=O)[O-])NSC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)OC

InChI

InChI=1S/C31H34N2O4S/c1-4-22-30(2,37-3)28(26-20-21-27(34)33(26)29(35)36)32-38-31(23-14-8-5-9-15-23,24-16-10-6-11-17-24)25-18-12-7-13-19-25/h5-21,26,28,32H,4,22H2,1-3H3,(H,35,36)/p-1