S-[2,5-bis(oxidanylidene)-1-[(4-phenoxyphenyl)methyl]pyrrolidin-3-yl] benzenecarbothioate

Systemtic Name: S-[2,5-bis(oxidanylidene)-1-[(4-phenoxyphenyl)methyl]pyrrolidin-3-yl] benzenecarbothioate Openeye Name: S-[2,5-dioxo-1-[(4-phenoxyphenyl)methyl]pyrrolidin-3-yl] benzenecarbothioate CAS Name: benzenecarbothioic acid S-[2,5-dioxo-1-[(4-phenoxyphenyl)methyl]-3-pyrrolidinyl] ester IUPAC Name: S-[2,5-dioxo-1-[(4-phenoxyphenyl)methyl]pyrrolidin-3-yl] benzenecarbothioate Traditional Name: thiobenzoic acid S-[2,5-diketo-1-(4-phenoxybenzyl)pyrrolidin-3-yl] ester Formula: C24H19NO4S MolecularWeight: 417.47696

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N(C1=O)CC2=CC=C(C=C2)OC3=CC=CC=C3)SC(=O)C4=CC=CC=C4

Isomeric SMILES

C1C(C(=O)N(C1=O)CC2=CC=C(C=C2)OC3=CC=CC=C3)SC(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H19NO4S/c26-22-15-21(30-24(28)18-7-3-1-4-8-18)23(27)25(22)16-17-11-13-20(14-12-17)29-19-9-5-2-6-10-19/h1-14,21H,15-16H2