2-[4-azanyl-5-(4-chlorophenyl)-6-ethyl-pyrimidin-2-yl]sulfanyl-N-(3-propan-2-yloxypropyl)ethanamide

Systemtic Name: 2-[4-azanyl-5-(4-chlorophenyl)-6-ethyl-pyrimidin-2-yl]sulfanyl-N-(3-propan-2-yloxypropyl)ethanamide Openeye Name: 2-[4-amino-5-(4-chlorophenyl)-6-ethyl-pyrimidin-2-yl]sulfanyl-N-(3-isopropoxypropyl)acetamide CAS Name: 2-[[4-amino-5-(4-chlorophenyl)-6-ethyl-2-pyrimidinyl]thio]-N-(3-propan-2-yloxypropyl)acetamide IUPAC Name: 2-[4-amino-5-(4-chlorophenyl)-6-ethylpyrimidin-2-yl]sulfanyl-N-(3-propan-2-yloxypropyl)acetamide Traditional Name: 2-[[4-amino-5-(4-chlorophenyl)-6-ethyl-pyrimidin-2-yl]thio]-N-(3-isopropoxypropyl)acetamide Formula: C20H27ClN4O2S MolecularWeight: 422.97198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)SCC(=O)NCCCOC(C)C)N)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCC1=C(C(=NC(=N1)SCC(=O)NCCCOC(C)C)N)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C20H27ClN4O2S/c1-4-16-18(14-6-8-15(21)9-7-14)19(22)25-20(24-16)28-12-17(26)23-10-5-11-27-13(2)3/h6-9,13H,4-5,10-12H2,1-3H3,(H,23,26)(H2,22,24,25)