propyl N'-[5-(methylcarbamoyl)-1H-imidazol-4-yl]-N-phenyl-carbamimidothioate

Systemtic Name: propyl N'-[5-(methylcarbamoyl)-1H-imidazol-4-yl]-N-phenyl-carbamimidothioate Openeye Name: 4-[[anilino(propylsulfanyl)methylene]amino]-N-methyl-1H-imidazole-5-carboxamide CAS Name: N'-[5-(methylcarbamoyl)-1H-imidazol-4-yl]-N-phenylcarbamimidothioic acid propyl ester IUPAC Name: propyl N'-[5-(methylcarbamoyl)-1H-imidazol-4-yl]-N-phenylcarbamimidothioate Traditional Name: 4-[[anilino-(propylthio)methylene]amino]-N-methyl-1H-imidazole-5-carboxamide Formula: C15H19N5OS MolecularWeight: 317.40926

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC(=NC1=C(NC=N1)C(=O)NC)NC2=CC=CC=C2

Isomeric SMILES

CCCSC(=NC1=C(NC=N1)C(=O)NC)NC2=CC=CC=C2

InChI

InChI=1S/C15H19N5OS/c1-3-9-22-15(19-11-7-5-4-6-8-11)20-13-12(14(21)16-2)17-10-18-13/h4-8,10H,3,9H2,1-2H3,(H,16,21)(H,17,18)(H,19,20)