tert-butyl N-[(2-methylpropan-2-yl)oxycarbonyl]-N-[5-(2-methylsulfanylphenyl)pyrimidin-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2-methylpropan-2-yl)oxycarbonyl]-N-[5-(2-methylsulfanylphenyl)pyrimidin-2-yl]carbamate Openeye Name: tert-butyl N-tert-butoxycarbonyl-N-[5-(2-methylsulfanylphenyl)pyrimidin-2-yl]carbamate CAS Name: N-[(2-methylpropan-2-yl)oxy-oxomethyl]-N-[5-[2-(methylthio)phenyl]-2-pyrimidinyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2-methylpropan-2-yl)oxycarbonyl]-N-[5-(2-methylsulfanylphenyl)pyrimidin-2-yl]carbamate Traditional Name: N-tert-butoxycarbonyl-N-[5-[2-(methylthio)phenyl]pyrimidin-2-yl]carbamic acid tert-butyl ester Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(C1=NC=C(C=N1)C2=CC=CC=C2SC)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N(C1=NC=C(C=N1)C2=CC=CC=C2SC)C(=O)OC(C)(C)C

InChI

InChI=1S/C21H27N3O4S/c1-20(2,3)27-18(25)24(19(26)28-21(4,5)6)17-22-12-14(13-23-17)15-10-8-9-11-16(15)29-7/h8-13H,1-7H3