O-[3-(4-azidophenyl)sulfanyl-2,5-bis(oxidanylidene)pyrrolidin-1-yl] propanethioate

Systemtic Name: O-[3-(4-azidophenyl)sulfanyl-2,5-bis(oxidanylidene)pyrrolidin-1-yl] propanethioate Openeye Name: O-[3-(4-azidophenyl)sulfanyl-2,5-dioxo-pyrrolidin-1-yl] propanethioate CAS Name: propanethioic acid O-[3-[(4-azidophenyl)thio]-2,5-dioxo-1-pyrrolidinyl] ester IUPAC Name: O-[3-(4-azidophenyl)sulfanyl-2,5-dioxopyrrolidin-1-yl] propanethioate Traditional Name: propanethioic acid O-[3-[(4-azidophenyl)thio]-2,5-diketo-pyrrolidino] ester Formula: C13H12N4O3S2 MolecularWeight: 336.38938

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=S)ON1C(=O)CC(C1=O)SC2=CC=C(C=C2)N=[N+]=[N-]

Isomeric SMILES

CCC(=S)ON1C(=O)CC(C1=O)SC2=CC=C(C=C2)N=[N+]=[N-]

InChI

InChI=1S/C13H12N4O3S2/c1-2-12(21)20-17-11(18)7-10(13(17)19)22-9-5-3-8(4-6-9)15-16-14/h3-6,10H,2,7H2,1H3