2-[3-(4-chloranylphenoxy)propylsulfanyl]-5-phenyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[3-(4-chloranylphenoxy)propylsulfanyl]-5-phenyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-2-[3-(4-chlorophenoxy)propylsulfanyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[3-(4-chlorophenoxy)propylthio]-5-phenyl-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[3-(4-chlorophenoxy)propylsulfanyl]-5-phenyl-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-2-[3-(4-chlorophenoxy)propylthio]-5-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C24H21ClN2O2S2 MolecularWeight: 469.01874

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(N=C1SCCCOC3=CC=C(C=C3)Cl)SC=C2C4=CC=CC=C4

Isomeric SMILES

C=CCN1C(=O)C2=C(N=C1SCCCOC3=CC=C(C=C3)Cl)SC=C2C4=CC=CC=C4

InChI

InChI=1S/C24H21ClN2O2S2/c1-2-13-27-23(28)21-20(17-7-4-3-5-8-17)16-31-22(21)26-24(27)30-15-6-14-29-19-11-9-18(25)10-12-19/h2-5,7-12,16H,1,6,13-15H2