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

Systemtic Name: N-[4-[2-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanylethanoyl]phenyl]propanamide Openeye Name: N-[4-[2-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanylacetyl]phenyl]propanamide CAS Name: N-[4-[2-[(1-butyl-4,5-dimethyl-2-imidazolyl)thio]-1-oxoethyl]phenyl]propanamide IUPAC Name: N-[4-[2-(1-butyl-4,5-dimethylimidazol-2-yl)sulfanylacetyl]phenyl]propanamide Traditional Name: N-[4-[2-[(1-butyl-4,5-dimethyl-imidazol-2-yl)thio]acetyl]phenyl]propionamide Formula: C20H27N3O2S MolecularWeight: 373.51228

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(N=C1SCC(=O)C2=CC=C(C=C2)NC(=O)CC)C)C

Isomeric SMILES

CCCCN1C(=C(N=C1SCC(=O)C2=CC=C(C=C2)NC(=O)CC)C)C

InChI

InChI=1S/C20H27N3O2S/c1-5-7-12-23-15(4)14(3)21-20(23)26-13-18(24)16-8-10-17(11-9-16)22-19(25)6-2/h8-11H,5-7,12-13H2,1-4H3,(H,22,25)