1-[3-[2-[tert-butyl(diphenyl)silyl]oxyethyl]phenyl]-3-(2-chloranyl-6-methyl-phenyl)-7-methylsulfonyl-4H-pyrimido[4,5-d]pyrimidin-2-one

Systemtic Name: 1-[3-[2-[tert-butyl(diphenyl)silyl]oxyethyl]phenyl]-3-(2-chloranyl-6-methyl-phenyl)-7-methylsulfonyl-4H-pyrimido[4,5-d]pyrimidin-2-one Openeye Name: 1-[3-[2-[tert-butyl(diphenyl)silyl]oxyethyl]phenyl]-3-(2-chloro-6-methyl-phenyl)-7-methylsulfonyl-4H-pyrimido[4,5-d]pyrimidin-2-one CAS Name: 1-[3-[2-[tert-butyl(diphenyl)silyl]oxyethyl]phenyl]-3-(2-chloro-6-methylphenyl)-7-methylsulfonyl-4H-pyrimido[4,5-d]pyrimidin-2-one IUPAC Name: 1-[3-[2-[tert-butyl(diphenyl)silyl]oxyethyl]phenyl]-3-(2-chloro-6-methylphenyl)-7-methylsulfonyl-4H-pyrimido[4,5-d]pyrimidin-2-one Traditional Name: 1-[3-[2-[tert-butyl(diphenyl)silyl]oxyethyl]phenyl]-3-(2-chloro-6-methyl-phenyl)-7-mesyl-4H-pyrimido[4,5-d]pyrimidin-2-one Formula: C38H39ClN4O4SSi MolecularWeight: 711.34416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)Cl)N2CC3=CN=C(N=C3N(C2=O)C4=CC=CC(=C4)CCO[Si](C5=CC=CC=C5)(C6=CC=CC=C6)C(C)(C)C)S(=O)(=O)C

Isomeric SMILES

CC1=C(C(=CC=C1)Cl)N2CC3=CN=C(N=C3N(C2=O)C4=CC=CC(=C4)CCO[Si](C5=CC=CC=C5)(C6=CC=CC=C6)C(C)(C)C)S(=O)(=O)C

InChI

InChI=1S/C38H39ClN4O4SSi/c1-27-14-12-21-33(39)34(27)42-26-29-25-40-36(48(5,45)46)41-35(29)43(37(42)44)30-16-13-15-28(24-30)22-23-47-49(38(2,3)4,31-17-8-6-9-18-31)32-19-10-7-11-20-32/h6-21,24-25H,22-23,26H2,1-5H3