2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-2-(1-phenylcyclopentyl)ethanal

Systemtic Name: 2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-2-(1-phenylcyclopentyl)ethanal Openeye Name: 2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-2-(1-phenylcyclopentyl)acetaldehyde CAS Name: 2-[(4,6-dimethoxy-2-pyrimidinyl)thio]-2-(1-phenylcyclopentyl)acetaldehyde IUPAC Name: 2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-2-(1-phenylcyclopentyl)acetaldehyde Traditional Name: 2-[(4,6-dimethoxypyrimidin-2-yl)thio]-2-(1-phenylcyclopentyl)acetaldehyde Formula: C19H22N2O3S MolecularWeight: 358.45458

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)SC(C=O)C2(CCCC2)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=CC(=NC(=N1)SC(C=O)C2(CCCC2)C3=CC=CC=C3)OC

InChI

InChI=1S/C19H22N2O3S/c1-23-16-12-17(24-2)21-18(20-16)25-15(13-22)19(10-6-7-11-19)14-8-4-3-5-9-14/h3-5,8-9,12-13,15H,6-7,10-11H2,1-2H3