5-(carbamothioylamino)-1-(phenylmethyl)imidazole-4-carboxamide

Systemtic Name: 5-(carbamothioylamino)-1-(phenylmethyl)imidazole-4-carboxamide Openeye Name: 1-benzyl-5-(carbamothioylamino)imidazole-4-carboxamide CAS Name: 5-(carbamothioylamino)-1-(phenylmethyl)-4-imidazolecarboxamide IUPAC Name: 1-benzyl-5-(carbamothioylamino)imidazole-4-carboxamide Traditional Name: 1-benzyl-5-thioureido-imidazole-4-carboxamide Formula: C12H13N5OS MolecularWeight: 275.32952

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=NC(=C2NC(=S)N)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CN2C=NC(=C2NC(=S)N)C(=O)N

InChI

InChI=1S/C12H13N5OS/c13-10(18)9-11(16-12(14)19)17(7-15-9)6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H2,13,18)(H3,14,16,19)