2-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-N-[(phenylmethyl)carbamoyl]propanamide

Systemtic Name: 2-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-N-[(phenylmethyl)carbamoyl]propanamide Openeye Name: N-(benzylcarbamoyl)-2-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-propanamide CAS Name: 2-[(1-butyl-4,5-dimethyl-2-imidazolyl)thio]-N-[oxo-[(phenylmethyl)amino]methyl]propanamide IUPAC Name: N-(benzylcarbamoyl)-2-(1-butyl-4,5-dimethylimidazol-2-yl)sulfanylpropanamide Traditional Name: N-(benzylcarbamoyl)-2-[(1-butyl-4,5-dimethyl-imidazol-2-yl)thio]propionamide Formula: C20H28N4O2S MolecularWeight: 388.52692

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(N=C1SC(C)C(=O)NC(=O)NCC2=CC=CC=C2)C)C

Isomeric SMILES

CCCCN1C(=C(N=C1SC(C)C(=O)NC(=O)NCC2=CC=CC=C2)C)C

InChI

InChI=1S/C20H28N4O2S/c1-5-6-12-24-15(3)14(2)22-20(24)27-16(4)18(25)23-19(26)21-13-17-10-8-7-9-11-17/h7-11,16H,5-6,12-13H2,1-4H3,(H2,21,23,25,26)