3-butyl-6-[5-chloranyl-2-oxidanyl-3-(pyrimidin-2-ylsulfanylmethyl)phenyl]carbonyl-1,4-dihydropyrido[2,3-d]pyrimidin-2-one

Systemtic Name: 3-butyl-6-[5-chloranyl-2-oxidanyl-3-(pyrimidin-2-ylsulfanylmethyl)phenyl]carbonyl-1,4-dihydropyrido[2,3-d]pyrimidin-2-one Openeye Name: 3-butyl-6-[5-chloro-2-hydroxy-3-(pyrimidin-2-ylsulfanylmethyl)benzoyl]-1,4-dihydropyrido[2,3-d]pyrimidin-2-one CAS Name: 3-butyl-6-[[5-chloro-2-hydroxy-3-[(2-pyrimidinylthio)methyl]phenyl]-oxomethyl]-1,4-dihydropyrido[2,3-d]pyrimidin-2-one IUPAC Name: 3-butyl-6-[5-chloro-2-hydroxy-3-(pyrimidin-2-ylsulfanylmethyl)benzoyl]-1,4-dihydropyrido[2,3-d]pyrimidin-2-one Traditional Name: 3-butyl-6-[5-chloro-2-hydroxy-3-[(2-pyrimidylthio)methyl]benzoyl]-1,4-dihydropyrido[2,3-d]pyrimidin-2-one Formula: C23H22ClN5O3S MolecularWeight: 483.97048

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CC2=C(NC1=O)N=CC(=C2)C(=O)C3=CC(=CC(=C3O)CSC4=NC=CC=N4)Cl

Isomeric SMILES

CCCCN1CC2=C(NC1=O)N=CC(=C2)C(=O)C3=CC(=CC(=C3O)CSC4=NC=CC=N4)Cl

InChI

InChI=1S/C23H22ClN5O3S/c1-2-3-7-29-12-15-8-14(11-27-21(15)28-23(29)32)19(30)18-10-17(24)9-16(20(18)31)13-33-22-25-5-4-6-26-22/h4-6,8-11,31H,2-3,7,12-13H2,1H3,(H,27,28,32)