3-(2,4-dichlorophenyl)-6-phenyl-2-prop-2-enylsulfanyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-(2,4-dichlorophenyl)-6-phenyl-2-prop-2-enylsulfanyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-allylsulfanyl-3-(2,4-dichlorophenyl)-6-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-(2,4-dichlorophenyl)-6-phenyl-2-(prop-2-enylthio)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-(2,4-dichlorophenyl)-6-phenyl-2-prop-2-enylsulfanylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-(allylthio)-3-(2,4-dichlorophenyl)-6-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C21H14Cl2N2OS2 MolecularWeight: 445.38466

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NC2=C(C=C(S2)C3=CC=CC=C3)C(=O)N1C4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

C=CCSC1=NC2=C(C=C(S2)C3=CC=CC=C3)C(=O)N1C4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C21H14Cl2N2OS2/c1-2-10-27-21-24-19-15(12-18(28-19)13-6-4-3-5-7-13)20(26)25(21)17-9-8-14(22)11-16(17)23/h2-9,11-12H,1,10H2