6-azanyl-N-(4-chlorophenyl)-4-oxidanylidene-2-pyrrolidin-1-yl-1H-pyrimidine-5-carbothioamide

Systemtic Name: 6-azanyl-N-(4-chlorophenyl)-4-oxidanylidene-2-pyrrolidin-1-yl-1H-pyrimidine-5-carbothioamide Openeye Name: 6-amino-N-(4-chlorophenyl)-4-oxo-2-pyrrolidin-1-yl-1H-pyrimidine-5-carbothioamide CAS Name: 6-amino-N-(4-chlorophenyl)-4-oxo-2-(1-pyrrolidinyl)-1H-pyrimidine-5-carbothioamide IUPAC Name: 6-amino-N-(4-chlorophenyl)-4-oxo-2-pyrrolidin-1-yl-1H-pyrimidine-5-carbothioamide Traditional Name: 6-amino-N-(4-chlorophenyl)-4-keto-2-pyrrolidino-1H-pyrimidine-5-carbothioamide Formula: C15H16ClN5OS MolecularWeight: 349.83844

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC(=O)C(=C(N2)N)C(=S)NC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCN(C1)C2=NC(=O)C(=C(N2)N)C(=S)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C15H16ClN5OS/c16-9-3-5-10(6-4-9)18-14(23)11-12(17)19-15(20-13(11)22)21-7-1-2-8-21/h3-6H,1-2,7-8H2,(H,18,23)(H3,17,19,20,22)