1-[4-azanyl-5-(4-chlorophenyl)-6-ethyl-pyrimidin-2-yl]sulfanyl-3-(4-methoxyphenoxy)propan-2-ol

Systemtic Name: 1-[4-azanyl-5-(4-chlorophenyl)-6-ethyl-pyrimidin-2-yl]sulfanyl-3-(4-methoxyphenoxy)propan-2-ol Openeye Name: 1-[4-amino-5-(4-chlorophenyl)-6-ethyl-pyrimidin-2-yl]sulfanyl-3-(4-methoxyphenoxy)propan-2-ol CAS Name: 1-[[4-amino-5-(4-chlorophenyl)-6-ethyl-2-pyrimidinyl]thio]-3-(4-methoxyphenoxy)-2-propanol IUPAC Name: 1-[4-amino-5-(4-chlorophenyl)-6-ethylpyrimidin-2-yl]sulfanyl-3-(4-methoxyphenoxy)propan-2-ol Traditional Name: 1-[[4-amino-5-(4-chlorophenyl)-6-ethyl-pyrimidin-2-yl]thio]-3-(4-methoxyphenoxy)propan-2-ol Formula: C22H24ClN3O3S MolecularWeight: 445.96226

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)SCC(COC2=CC=C(C=C2)OC)O)N)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCC1=C(C(=NC(=N1)SCC(COC2=CC=C(C=C2)OC)O)N)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H24ClN3O3S/c1-3-19-20(14-4-6-15(23)7-5-14)21(24)26-22(25-19)30-13-16(27)12-29-18-10-8-17(28-2)9-11-18/h4-11,16,27H,3,12-13H2,1-2H3,(H2,24,25,26)