N-[(1-methylimidazol-2-yl)methyl]-2-(4-methylpyrimidin-2-yl)sulfanyl-N-(3-phenylpropyl)ethanamide

Systemtic Name: N-[(1-methylimidazol-2-yl)methyl]-2-(4-methylpyrimidin-2-yl)sulfanyl-N-(3-phenylpropyl)ethanamide Openeye Name: N-[(1-methylimidazol-2-yl)methyl]-2-(4-methylpyrimidin-2-yl)sulfanyl-N-(3-phenylpropyl)acetamide CAS Name: N-[(1-methyl-2-imidazolyl)methyl]-2-[(4-methyl-2-pyrimidinyl)thio]-N-(3-phenylpropyl)acetamide IUPAC Name: N-[(1-methylimidazol-2-yl)methyl]-2-(4-methylpyrimidin-2-yl)sulfanyl-N-(3-phenylpropyl)acetamide Traditional Name: N-[(1-methylimidazol-2-yl)methyl]-2-[(4-methylpyrimidin-2-yl)thio]-N-(3-phenylpropyl)acetamide Formula: C21H25N5OS MolecularWeight: 395.5211

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)SCC(=O)N(CCCC2=CC=CC=C2)CC3=NC=CN3C

Isomeric SMILES

CC1=NC(=NC=C1)SCC(=O)N(CCCC2=CC=CC=C2)CC3=NC=CN3C

InChI

InChI=1S/C21H25N5OS/c1-17-10-11-23-21(24-17)28-16-20(27)26(15-19-22-12-14-25(19)2)13-6-9-18-7-4-3-5-8-18/h3-5,7-8,10-12,14H,6,9,13,15-16H2,1-2H3