4-[2,4-bis(ethylsulfanyl)-5-phenyl-pyrido[2,3-d]pyrimidin-7-yl]-5-methyl-2-phenyl-4H-pyrazol-3-one

Systemtic Name: 4-[2,4-bis(ethylsulfanyl)-5-phenyl-pyrido[2,3-d]pyrimidin-7-yl]-5-methyl-2-phenyl-4H-pyrazol-3-one Openeye Name: 4-[2,4-bis(ethylsulfanyl)-5-phenyl-pyrido[2,3-d]pyrimidin-7-yl]-5-methyl-2-phenyl-4H-pyrazol-3-one CAS Name: 4-[2,4-bis(ethylthio)-5-phenyl-7-pyrido[2,3-d]pyrimidinyl]-5-methyl-2-phenyl-4H-pyrazol-3-one IUPAC Name: 4-[2,4-bis(ethylsulfanyl)-5-phenylpyrido[2,3-d]pyrimidin-7-yl]-5-methyl-2-phenyl-4H-pyrazol-3-one Traditional Name: 4-[2,4-bis(ethylthio)-5-phenyl-pyrido[2,3-d]pyrimidin-7-yl]-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C27H25N5OS2 MolecularWeight: 499.6503

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC(=NC2=C1C(=CC(=N2)C3C(=NN(C3=O)C4=CC=CC=C4)C)C5=CC=CC=C5)SCC

Isomeric SMILES

CCSC1=NC(=NC2=C1C(=CC(=N2)C3C(=NN(C3=O)C4=CC=CC=C4)C)C5=CC=CC=C5)SCC

InChI

InChI=1S/C27H25N5OS2/c1-4-34-25-23-20(18-12-8-6-9-13-18)16-21(28-24(23)29-27(30-25)35-5-2)22-17(3)31-32(26(22)33)19-14-10-7-11-15-19/h6-16,22H,4-5H2,1-3H3