N-hexyl-3-phenyl-2-sulfanylidene-1H-imidazole-4-carboxamide

Systemtic Name: N-hexyl-3-phenyl-2-sulfanylidene-1H-imidazole-4-carboxamide Openeye Name: N-hexyl-3-phenyl-2-thioxo-1H-imidazole-4-carboxamide CAS Name: N-hexyl-3-phenyl-2-sulfanylidene-1H-imidazole-4-carboxamide IUPAC Name: N-hexyl-3-phenyl-2-sulfanylidene-1H-imidazole-4-carboxamide Traditional Name: N-hexyl-3-phenyl-2-thioxo-4-imidazoline-4-carboxamide Formula: C16H21N3OS MolecularWeight: 303.42244

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)C1=CNC(=S)N1C2=CC=CC=C2

Isomeric SMILES

CCCCCCNC(=O)C1=CNC(=S)N1C2=CC=CC=C2

InChI

InChI=1S/C16H21N3OS/c1-2-3-4-8-11-17-15(20)14-12-18-16(21)19(14)13-9-6-5-7-10-13/h5-7,9-10,12H,2-4,8,11H2,1H3,(H,17,20)(H,18,21)