1-(phenylmethyl)-5-[[(phenylmethyl)carbamothioylamino]methyl]imidazole-4-carboxamide

Systemtic Name: 1-(phenylmethyl)-5-[[(phenylmethyl)carbamothioylamino]methyl]imidazole-4-carboxamide Openeye Name: 1-benzyl-5-[(benzylcarbamothioylamino)methyl]imidazole-4-carboxamide CAS Name: 1-(phenylmethyl)-5-[[[[(phenylmethyl)amino]-sulfanylidenemethyl]amino]methyl]-4-imidazolecarboxamide IUPAC Name: 1-benzyl-5-[(benzylcarbamothioylamino)methyl]imidazole-4-carboxamide Traditional Name: 1-benzyl-5-[(benzylthiocarbamoylamino)methyl]imidazole-4-carboxamide Formula: C20H21N5OS MolecularWeight: 379.47864

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=S)NCC2=C(N=CN2CC3=CC=CC=C3)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)NCC2=C(N=CN2CC3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C20H21N5OS/c21-19(26)18-17(25(14-24-18)13-16-9-5-2-6-10-16)12-23-20(27)22-11-15-7-3-1-4-8-15/h1-10,14H,11-13H2,(H2,21,26)(H2,22,23,27)