N-[2-(2-azanylethyldisulfanyl)ethyl]-1-(4-methanoylphenyl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-[2-(2-azanylethyldisulfanyl)ethyl]-1-(4-methanoylphenyl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: N-[2-(2-aminoethyldisulfanyl)ethyl]-1-(4-formylphenyl)sulfonyl-pyrrolidine-2-carboxamide CAS Name: N-[2-(2-aminoethyldisulfanyl)ethyl]-1-(4-formylphenyl)sulfonyl-2-pyrrolidinecarboxamide IUPAC Name: N-[2-(2-aminoethyldisulfanyl)ethyl]-1-(4-formylphenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: N-[2-(2-aminoethyldisulfanyl)ethyl]-1-(4-formylphenyl)sulfonyl-pyrrolidine-2-carboxamide Formula: C16H23N3O4S3 MolecularWeight: 417.56652

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)C=O)C(=O)NCCSSCCN

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)C=O)C(=O)NCCSSCCN

InChI

InChI=1S/C16H23N3O4S3/c17-7-10-24-25-11-8-18-16(21)15-2-1-9-19(15)26(22,23)14-5-3-13(12-20)4-6-14/h3-6,12,15H,1-2,7-11,17H2,(H,18,21)