[1-(3-chlorophenyl)-2-oxidanylidene-pyrrolidin-3-yl] N'-methylcarbamimidothioate

Systemtic Name: [1-(3-chlorophenyl)-2-oxidanylidene-pyrrolidin-3-yl] N'-methylcarbamimidothioate Openeye Name: 2-[1-(3-chlorophenyl)-2-oxo-pyrrolidin-3-yl]-3-methyl-isothiourea CAS Name: N'-methylcarbamimidothioic acid [1-(3-chlorophenyl)-2-oxo-3-pyrrolidinyl] ester IUPAC Name: [1-(3-chlorophenyl)-2-oxopyrrolidin-3-yl] N'-methylcarbamimidothioate Traditional Name: 2-[1-(3-chlorophenyl)-2-keto-pyrrolidin-3-yl]-3-methyl-isothiourea Formula: C12H14ClN3OS MolecularWeight: 283.77706

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Descriptors Computed from Structure

Canonical SMILES:

CN=C(N)SC1CCN(C1=O)C2=CC(=CC=C2)Cl

Isomeric SMILES

CN=C(N)SC1CCN(C1=O)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C12H14ClN3OS/c1-15-12(14)18-10-5-6-16(11(10)17)9-4-2-3-8(13)7-9/h2-4,7,10H,5-6H2,1H3,(H2,14,15)