methyl 2-azanyl-3-[2-methoxy-6-(phenylcarbamoyl)phenyl]selanylsulfanyl-3-methyl-butanoate

Systemtic Name: methyl 2-azanyl-3-[2-methoxy-6-(phenylcarbamoyl)phenyl]selanylsulfanyl-3-methyl-butanoate Openeye Name: methyl 2-amino-3-[2-methoxy-6-(phenylcarbamoyl)phenyl]selanylsulfanyl-3-methyl-butanoate CAS Name: 2-amino-3-[[[2-[anilino(oxo)methyl]-6-methoxyphenyl]seleno]thio]-3-methylbutanoic acid methyl ester IUPAC Name: methyl 2-amino-3-[2-methoxy-6-(phenylcarbamoyl)phenyl]selanylsulfanyl-3-methylbutanoate Traditional Name: 2-amino-3-[[[2-methoxy-6-(phenylcarbamoyl)phenyl]seleno]thio]-3-methyl-butyric acid methyl ester Formula: C20H24N2O4SSe MolecularWeight: 467.44056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(C(=O)OC)N)S[Se]C1=C(C=CC=C1OC)C(=O)NC2=CC=CC=C2

Isomeric SMILES

CC(C)(C(C(=O)OC)N)S[Se]C1=C(C=CC=C1OC)C(=O)NC2=CC=CC=C2

InChI

InChI=1S/C20H24N2O4SSe/c1-20(2,17(21)19(24)26-4)27-28-16-14(11-8-12-15(16)25-3)18(23)22-13-9-6-5-7-10-13/h5-12,17H,21H2,1-4H3,(H,22,23)