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

Systemtic Name: [1-(4-chlorophenyl)-2-oxidanylidene-pyrrolidin-3-yl] carbamimidothioate Openeye Name: 2-[1-(4-chlorophenyl)-2-oxo-pyrrolidin-3-yl]isothiourea CAS Name: carbamimidothioic acid [1-(4-chlorophenyl)-2-oxo-3-pyrrolidinyl] ester IUPAC Name: [1-(4-chlorophenyl)-2-oxopyrrolidin-3-yl] carbamimidothioate Traditional Name: 2-[1-(4-chlorophenyl)-2-keto-pyrrolidin-3-yl]isothiourea Formula: C11H12ClN3OS MolecularWeight: 269.75048

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C1SC(=N)N)C2=CC=C(C=C2)Cl

Isomeric SMILES

C1CN(C(=O)C1SC(=N)N)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C11H12ClN3OS/c12-7-1-3-8(4-2-7)15-6-5-9(10(15)16)17-11(13)14/h1-4,9H,5-6H2,(H3,13,14)