[3-[[6-methyl-2-(phenylmethylsulfanyl)pyrimidin-4-yl]amino]phenyl] 2-methylpropyl carbonate

Systemtic Name: [3-[[6-methyl-2-(phenylmethylsulfanyl)pyrimidin-4-yl]amino]phenyl] 2-methylpropyl carbonate Openeye Name: [3-[(2-benzylsulfanyl-6-methyl-pyrimidin-4-yl)amino]phenyl] isobutyl carbonate CAS Name: carbonic acid [3-[[6-methyl-2-(phenylmethylthio)-4-pyrimidinyl]amino]phenyl] 2-methylpropyl ester IUPAC Name: [3-[(2-benzylsulfanyl-6-methylpyrimidin-4-yl)amino]phenyl] 2-methylpropyl carbonate Traditional Name: carbonic acid [3-[[2-(benzylthio)-6-methyl-pyrimidin-4-yl]amino]phenyl] isobutyl ester Formula: C23H25N3O3S MolecularWeight: 423.5279

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=CC=CC=C2)NC3=CC(=CC=C3)OC(=O)OCC(C)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=CC=CC=C2)NC3=CC(=CC=C3)OC(=O)OCC(C)C

InChI

InChI=1S/C23H25N3O3S/c1-16(2)14-28-23(27)29-20-11-7-10-19(13-20)25-21-12-17(3)24-22(26-21)30-15-18-8-5-4-6-9-18/h4-13,16H,14-15H2,1-3H3,(H,24,25,26)