[1-(4-methoxyphenyl)-2-oxidanylidene-pyrrolidin-3-yl] carbamimidothioate

Systemtic Name: [1-(4-methoxyphenyl)-2-oxidanylidene-pyrrolidin-3-yl] carbamimidothioate Openeye Name: 2-[1-(4-methoxyphenyl)-2-oxo-pyrrolidin-3-yl]isothiourea CAS Name: carbamimidothioic acid [1-(4-methoxyphenyl)-2-oxo-3-pyrrolidinyl] ester IUPAC Name: [1-(4-methoxyphenyl)-2-oxopyrrolidin-3-yl] carbamimidothioate Traditional Name: 2-[2-keto-1-(4-methoxyphenyl)pyrrolidin-3-yl]isothiourea Formula: C12H15N3O2S MolecularWeight: 265.3314

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCC(C2=O)SC(=N)N

Isomeric SMILES

COC1=CC=C(C=C1)N2CCC(C2=O)SC(=N)N

InChI

InChI=1S/C12H15N3O2S/c1-17-9-4-2-8(3-5-9)15-7-6-10(11(15)16)18-12(13)14/h2-5,10H,6-7H2,1H3,(H3,13,14)