2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-3-phenyl-pentan-1-ol

Systemtic Name: 2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-3-phenyl-pentan-1-ol Openeye Name: 2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-3-phenyl-pentan-1-ol CAS Name: 2-[(4,6-dimethoxy-2-pyrimidinyl)thio]-3-phenyl-1-pentanol IUPAC Name: 2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-3-phenylpentan-1-ol Traditional Name: 2-[(4,6-dimethoxypyrimidin-2-yl)thio]-3-phenyl-pentan-1-ol Formula: C17H22N2O3S MolecularWeight: 334.43318

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(CO)SC2=NC(=CC(=N2)OC)OC

Isomeric SMILES

CCC(C1=CC=CC=C1)C(CO)SC2=NC(=CC(=N2)OC)OC

InChI

InChI=1S/C17H22N2O3S/c1-4-13(12-8-6-5-7-9-12)14(11-20)23-17-18-15(21-2)10-16(19-17)22-3/h5-10,13-14,20H,4,11H2,1-3H3