5-(phenylcarbonylcarbamothioylamino)-1-propyl-imidazole-4-carboxamide

Systemtic Name: 5-(phenylcarbonylcarbamothioylamino)-1-propyl-imidazole-4-carboxamide Openeye Name: 5-(benzoylcarbamothioylamino)-1-propyl-imidazole-4-carboxamide CAS Name: 5-[[benzamido(sulfanylidene)methyl]amino]-1-propyl-4-imidazolecarboxamide IUPAC Name: 5-(benzoylcarbamothioylamino)-1-propylimidazole-4-carboxamide Traditional Name: 5-(benzoylthiocarbamoylamino)-1-propyl-imidazole-4-carboxamide Formula: C15H17N5O2S MolecularWeight: 331.39278

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=NC(=C1NC(=S)NC(=O)C2=CC=CC=C2)C(=O)N

Isomeric SMILES

CCCN1C=NC(=C1NC(=S)NC(=O)C2=CC=CC=C2)C(=O)N

InChI

InChI=1S/C15H17N5O2S/c1-2-8-20-9-17-11(12(16)21)13(20)18-15(23)19-14(22)10-6-4-3-5-7-10/h3-7,9H,2,8H2,1H3,(H2,16,21)(H2,18,19,22,23)