N-[4-(methanethioylamino)butyl]-N-methyl-4-phenyl-imidazole-1-carboxamide

Systemtic Name: N-[4-(methanethioylamino)butyl]-N-methyl-4-phenyl-imidazole-1-carboxamide Openeye Name: N-[4-(methanethioylamino)butyl]-N-methyl-4-phenyl-imidazole-1-carboxamide CAS Name: N-[4-(methanethioylamino)butyl]-N-methyl-4-phenyl-1-imidazolecarboxamide IUPAC Name: N-[4-(methanethioylamino)butyl]-N-methyl-4-phenylimidazole-1-carboxamide Traditional Name: N-methyl-4-phenyl-N-[4-(thioformylamino)butyl]imidazole-1-carboxamide Formula: C16H20N4OS MolecularWeight: 316.4212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCCCNC=S)C(=O)N1C=C(N=C1)C2=CC=CC=C2

Isomeric SMILES

CN(CCCCNC=S)C(=O)N1C=C(N=C1)C2=CC=CC=C2

InChI

InChI=1S/C16H20N4OS/c1-19(10-6-5-9-17-13-22)16(21)20-11-15(18-12-20)14-7-3-2-4-8-14/h2-4,7-8,11-13H,5-6,9-10H2,1H3,(H,17,22)