[1-(4-methoxyphenyl)-2-oxidanylidene-pyrrolidin-3-yl] N,N'-dimethylcarbamimidothioate

Systemtic Name: [1-(4-methoxyphenyl)-2-oxidanylidene-pyrrolidin-3-yl] N,N'-dimethylcarbamimidothioate Openeye Name: 2-[1-(4-methoxyphenyl)-2-oxo-pyrrolidin-3-yl]-1,3-dimethyl-isothiourea CAS Name: N,N'-dimethylcarbamimidothioic acid [1-(4-methoxyphenyl)-2-oxo-3-pyrrolidinyl] ester IUPAC Name: [1-(4-methoxyphenyl)-2-oxopyrrolidin-3-yl] N,N'-dimethylcarbamimidothioate Traditional Name: 2-[2-keto-1-(4-methoxyphenyl)pyrrolidin-3-yl]-1,3-dimethyl-isothiourea Formula: C14H19N3O2S MolecularWeight: 293.38456

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=NC)SC1CCN(C1=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CNC(=NC)SC1CCN(C1=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C14H19N3O2S/c1-15-14(16-2)20-12-8-9-17(13(12)18)10-4-6-11(19-3)7-5-10/h4-7,12H,8-9H2,1-3H3,(H,15,16)