2-(2-azanyl-3-phenyl-propyl)sulfanyl-6-propan-2-yl-1H-pyrimidin-4-one

Systemtic Name: 2-(2-azanyl-3-phenyl-propyl)sulfanyl-6-propan-2-yl-1H-pyrimidin-4-one Openeye Name: 2-(2-amino-3-phenyl-propyl)sulfanyl-6-isopropyl-1H-pyrimidin-4-one CAS Name: 2-[(2-amino-3-phenylpropyl)thio]-6-propan-2-yl-1H-pyrimidin-4-one IUPAC Name: 2-(2-amino-3-phenylpropyl)sulfanyl-6-propan-2-yl-1H-pyrimidin-4-one Traditional Name: 2-[(2-amino-3-phenyl-propyl)thio]-6-isopropyl-1H-pyrimidin-4-one Formula: C16H21N3OS MolecularWeight: 303.42244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=O)N=C(N1)SCC(CC2=CC=CC=C2)N

Isomeric SMILES

CC(C)C1=CC(=O)N=C(N1)SCC(CC2=CC=CC=C2)N

InChI

InChI=1S/C16H21N3OS/c1-11(2)14-9-15(20)19-16(18-14)21-10-13(17)8-12-6-4-3-5-7-12/h3-7,9,11,13H,8,10,17H2,1-2H3,(H,18,19,20)