3-[4-(4-chloranylphenoxy)butyl]-6-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[4-(4-chloranylphenoxy)butyl]-6-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[4-(4-chlorophenoxy)butyl]-6-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[4-(4-chlorophenoxy)butyl]-6-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[4-(4-chlorophenoxy)butyl]-6-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[4-(4-chlorophenoxy)butyl]-6-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C22H19ClN2O2S MolecularWeight: 410.91646

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC3=C(S2)N=CN(C3=O)CCCCOC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=CC3=C(S2)N=CN(C3=O)CCCCOC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H19ClN2O2S/c23-17-8-10-18(11-9-17)27-13-5-4-12-25-15-24-21-19(22(25)26)14-20(28-21)16-6-2-1-3-7-16/h1-3,6-11,14-15H,4-5,12-13H2