2-[(3R)-1-(3-methoxycarbonyl-5-propyl-thiophen-2-yl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanylbenzoate

Systemtic Name: 2-[(3R)-1-(3-methoxycarbonyl-5-propyl-thiophen-2-yl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanylbenzoate Openeye Name: 2-[(3R)-1-(3-methoxycarbonyl-5-propyl-2-thienyl)-2,5-dioxo-pyrrolidin-3-yl]sulfanylbenzoate CAS Name: 2-[[(3R)-1-(3-methoxycarbonyl-5-propyl-2-thiophenyl)-2,5-dioxo-3-pyrrolidinyl]thio]benzoate IUPAC Name: 2-[(3R)-1-(3-methoxycarbonyl-5-propylthiophen-2-yl)-2,5-dioxopyrrolidin-3-yl]sulfanylbenzoate Traditional Name: 2-[[(3R)-1-(3-carbomethoxy-5-propyl-2-thienyl)-2,5-diketo-pyrrolidin-3-yl]thio]benzoate Formula: C20H18NO6S2- MolecularWeight: 432.49002

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(S1)N2C(=O)CC(C2=O)SC3=CC=CC=C3C(=O)[O-])C(=O)OC

Isomeric SMILES

CCCC1=CC(=C(S1)N2C(=O)C[C@H](C2=O)SC3=CC=CC=C3C(=O)[O-])C(=O)OC

InChI

InChI=1S/C20H19NO6S2/c1-3-6-11-9-13(20(26)27-2)18(28-11)21-16(22)10-15(17(21)23)29-14-8-5-4-7-12(14)19(24)25/h4-5,7-9,15H,3,6,10H2,1-2H3,(H,24,25)/p-1/t15-/m1/s1