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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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