tert-butyl N-(1-cyclohexyl-3-oxidanyl-4-pyrimidin-2-ylsulfanyl-butan-2-yl)carbamate

Systemtic Name: tert-butyl N-(1-cyclohexyl-3-oxidanyl-4-pyrimidin-2-ylsulfanyl-butan-2-yl)carbamate Openeye Name: tert-butyl N-[1-(cyclohexylmethyl)-2-hydroxy-3-pyrimidin-2-ylsulfanyl-propyl]carbamate CAS Name: N-[1-cyclohexyl-3-hydroxy-4-(2-pyrimidinylthio)butan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(1-cyclohexyl-3-hydroxy-4-pyrimidin-2-ylsulfanylbutan-2-yl)carbamate Traditional Name: N-[1-(cyclohexylmethyl)-2-hydroxy-3-(2-pyrimidylthio)propyl]carbamic acid tert-butyl ester Formula: C19H31N3O3S MolecularWeight: 381.53274

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1CCCCC1)C(CSC2=NC=CC=N2)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1CCCCC1)C(CSC2=NC=CC=N2)O

InChI

InChI=1S/C19H31N3O3S/c1-19(2,3)25-18(24)22-15(12-14-8-5-4-6-9-14)16(23)13-26-17-20-10-7-11-21-17/h7,10-11,14-16,23H,4-6,8-9,12-13H2,1-3H3,(H,22,24)