N-(4-butoxyphenyl)-3-(1-methylimidazol-2-yl)sulfanyl-propanamide

Systemtic Name: N-(4-butoxyphenyl)-3-(1-methylimidazol-2-yl)sulfanyl-propanamide Openeye Name: N-(4-butoxyphenyl)-3-(1-methylimidazol-2-yl)sulfanyl-propanamide CAS Name: N-(4-butoxyphenyl)-3-[(1-methyl-2-imidazolyl)thio]propanamide IUPAC Name: N-(4-butoxyphenyl)-3-(1-methylimidazol-2-yl)sulfanylpropanamide Traditional Name: N-(4-butoxyphenyl)-3-[(1-methylimidazol-2-yl)thio]propionamide Formula: C17H23N3O2S MolecularWeight: 333.44842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC(=O)CCSC2=NC=CN2C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC(=O)CCSC2=NC=CN2C

InChI

InChI=1S/C17H23N3O2S/c1-3-4-12-22-15-7-5-14(6-8-15)19-16(21)9-13-23-17-18-10-11-20(17)2/h5-8,10-11H,3-4,9,12-13H2,1-2H3,(H,19,21)