5-nitro-6-phenylsulfanyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine

Systemtic Name: 5-nitro-6-phenylsulfanyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine Openeye Name: 5-nitro-6-phenylsulfanyl-N-(2,2,6,6-tetramethyl-4-piperidyl)pyrimidin-4-amine CAS Name: 5-nitro-6-(phenylthio)-N-(2,2,6,6-tetramethyl-4-piperidinyl)-4-pyrimidinamine IUPAC Name: 5-nitro-6-phenylsulfanyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine Traditional Name: [5-nitro-6-(phenylthio)pyrimidin-4-yl]-(2,2,6,6-tetramethyl-4-piperidyl)amine Formula: C19H25N5O2S MolecularWeight: 387.4991

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC(N1)(C)C)NC2=C(C(=NC=N2)SC3=CC=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1(CC(CC(N1)(C)C)NC2=C(C(=NC=N2)SC3=CC=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C19H25N5O2S/c1-18(2)10-13(11-19(3,4)23-18)22-16-15(24(25)26)17(21-12-20-16)27-14-8-6-5-7-9-14/h5-9,12-13,23H,10-11H2,1-4H3,(H,20,21,22)