2-[[2-(4-chloranylphenoxy)ethyl-methyl-amino]methyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[[2-(4-chloranylphenoxy)ethyl-methyl-amino]methyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[[2-(4-chlorophenoxy)ethyl-methyl-amino]methyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[2-(4-chlorophenoxy)ethyl-methylamino]methyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[[2-(4-chlorophenoxy)ethyl-methylamino]methyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[2-(4-chlorophenoxy)ethyl-methyl-amino]methyl]-6-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C22H20ClN3O2S MolecularWeight: 425.9311

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCOC1=CC=C(C=C1)Cl)CC2=NC3=C(C=C(S3)C4=CC=CC=C4)C(=O)N2

Isomeric SMILES

CN(CCOC1=CC=C(C=C1)Cl)CC2=NC3=C(C=C(S3)C4=CC=CC=C4)C(=O)N2

InChI

InChI=1S/C22H20ClN3O2S/c1-26(11-12-28-17-9-7-16(23)8-10-17)14-20-24-21(27)18-13-19(29-22(18)25-20)15-5-3-2-4-6-15/h2-10,13H,11-12,14H2,1H3,(H,24,25,27)