4-[(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanylmethyl]-N-phenyl-benzamide

Systemtic Name: 4-[(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanylmethyl]-N-phenyl-benzamide Openeye Name: 4-[(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanylmethyl]-N-phenyl-benzamide CAS Name: 4-[[(1-butyl-4,5-dimethyl-2-imidazolyl)thio]methyl]-N-phenylbenzamide IUPAC Name: 4-[(1-butyl-4,5-dimethylimidazol-2-yl)sulfanylmethyl]-N-phenylbenzamide Traditional Name: 4-[[(1-butyl-4,5-dimethyl-imidazol-2-yl)thio]methyl]-N-phenyl-benzamide Formula: C23H27N3OS MolecularWeight: 393.54498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(N=C1SCC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3)C)C

Isomeric SMILES

CCCCN1C(=C(N=C1SCC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3)C)C

InChI

InChI=1S/C23H27N3OS/c1-4-5-15-26-18(3)17(2)24-23(26)28-16-19-11-13-20(14-12-19)22(27)25-21-9-7-6-8-10-21/h6-14H,4-5,15-16H2,1-3H3,(H,25,27)