2-(2-azanyl-6-methyl-pyrimidin-4-yl)sulfanyl-N-(3-phenylpropyl)ethanamide

Systemtic Name: 2-(2-azanyl-6-methyl-pyrimidin-4-yl)sulfanyl-N-(3-phenylpropyl)ethanamide Openeye Name: 2-(2-amino-6-methyl-pyrimidin-4-yl)sulfanyl-N-(3-phenylpropyl)acetamide CAS Name: 2-[(2-amino-6-methyl-4-pyrimidinyl)thio]-N-(3-phenylpropyl)acetamide IUPAC Name: 2-(2-amino-6-methylpyrimidin-4-yl)sulfanyl-N-(3-phenylpropyl)acetamide Traditional Name: 2-[(2-amino-6-methyl-pyrimidin-4-yl)thio]-N-(3-phenylpropyl)acetamide Formula: C16H20N4OS MolecularWeight: 316.4212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N)SCC(=O)NCCCC2=CC=CC=C2

Isomeric SMILES

CC1=CC(=NC(=N1)N)SCC(=O)NCCCC2=CC=CC=C2

InChI

InChI=1S/C16H20N4OS/c1-12-10-15(20-16(17)19-12)22-11-14(21)18-9-5-8-13-6-3-2-4-7-13/h2-4,6-7,10H,5,8-9,11H2,1H3,(H,18,21)(H2,17,19,20)