ethyl 2-azanyl-3-[1-(4-iodophenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanyl-propanoate

Systemtic Name: ethyl 2-azanyl-3-[1-(4-iodophenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanyl-propanoate Openeye Name: ethyl 2-amino-3-[1-(4-iodophenyl)-2,5-dioxo-pyrrolidin-3-yl]sulfanyl-propanoate CAS Name: 2-amino-3-[[1-(4-iodophenyl)-2,5-dioxo-3-pyrrolidinyl]thio]propanoic acid ethyl ester IUPAC Name: ethyl 2-amino-3-[1-(4-iodophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanylpropanoate Traditional Name: 2-amino-3-[[1-(4-iodophenyl)-2,5-diketo-pyrrolidin-3-yl]thio]propionic acid ethyl ester Formula: C15H17IN2O4S MolecularWeight: 448.27595

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CSC1CC(=O)N(C1=O)C2=CC=C(C=C2)I)N

Isomeric SMILES

CCOC(=O)C(CSC1CC(=O)N(C1=O)C2=CC=C(C=C2)I)N

InChI

InChI=1S/C15H17IN2O4S/c1-2-22-15(21)11(17)8-23-12-7-13(19)18(14(12)20)10-5-3-9(16)4-6-10/h3-6,11-12H,2,7-8,17H2,1H3