(2S)-1-(2-hydroxyethyloxy)-3-(4-methyl-6-phenylazanyl-pyrimidin-2-yl)sulfanyl-propan-2-ol

Systemtic Name: (2S)-1-(2-hydroxyethyloxy)-3-(4-methyl-6-phenylazanyl-pyrimidin-2-yl)sulfanyl-propan-2-ol Openeye Name: (2S)-1-(4-anilino-6-methyl-pyrimidin-2-yl)sulfanyl-3-(2-hydroxyethoxy)propan-2-ol CAS Name: (2S)-1-[(4-anilino-6-methyl-2-pyrimidinyl)thio]-3-(2-hydroxyethoxy)-2-propanol IUPAC Name: (2S)-1-(4-anilino-6-methylpyrimidin-2-yl)sulfanyl-3-(2-hydroxyethoxy)propan-2-ol Traditional Name: (2S)-1-[(4-anilino-6-methyl-pyrimidin-2-yl)thio]-3-(2-hydroxyethoxy)propan-2-ol Formula: C16H21N3O3S MolecularWeight: 335.42124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(COCCO)O)NC2=CC=CC=C2

Isomeric SMILES

CC1=CC(=NC(=N1)SC[C@H](COCCO)O)NC2=CC=CC=C2

InChI

InChI=1S/C16H21N3O3S/c1-12-9-15(18-13-5-3-2-4-6-13)19-16(17-12)23-11-14(21)10-22-8-7-20/h2-6,9,14,20-21H,7-8,10-11H2,1H3,(H,17,18,19)/t14-/m0/s1