2-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-N-[(2,4,5-trimethoxyphenyl)methyl]ethanamide

Systemtic Name: 2-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-N-[(2,4,5-trimethoxyphenyl)methyl]ethanamide Openeye Name: 2-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-N-[(2,4,5-trimethoxyphenyl)methyl]acetamide CAS Name: 2-[(1-butyl-4,5-dimethyl-2-imidazolyl)thio]-N-[(2,4,5-trimethoxyphenyl)methyl]acetamide IUPAC Name: 2-(1-butyl-4,5-dimethylimidazol-2-yl)sulfanyl-N-[(2,4,5-trimethoxyphenyl)methyl]acetamide Traditional Name: 2-[(1-butyl-4,5-dimethyl-imidazol-2-yl)thio]-N-(2,4,5-trimethoxybenzyl)acetamide Formula: C21H31N3O4S MolecularWeight: 421.55354

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(N=C1SCC(=O)NCC2=CC(=C(C=C2OC)OC)OC)C)C

Isomeric SMILES

CCCCN1C(=C(N=C1SCC(=O)NCC2=CC(=C(C=C2OC)OC)OC)C)C

InChI

InChI=1S/C21H31N3O4S/c1-7-8-9-24-15(3)14(2)23-21(24)29-13-20(25)22-12-16-10-18(27-5)19(28-6)11-17(16)26-4/h10-11H,7-9,12-13H2,1-6H3,(H,22,25)