1-[4-(4,6-dimethylpyrimidin-2-yl)sulfanyl-6-methyl-pyrimidin-2-yl]azepane

Systemtic Name: 1-[4-(4,6-dimethylpyrimidin-2-yl)sulfanyl-6-methyl-pyrimidin-2-yl]azepane Openeye Name: 1-[4-(4,6-dimethylpyrimidin-2-yl)sulfanyl-6-methyl-pyrimidin-2-yl]azepane CAS Name: 1-[4-[(4,6-dimethyl-2-pyrimidinyl)thio]-6-methyl-2-pyrimidinyl]azepane IUPAC Name: 1-[4-(4,6-dimethylpyrimidin-2-yl)sulfanyl-6-methylpyrimidin-2-yl]azepane Traditional Name: 1-[4-[(4,6-dimethylpyrimidin-2-yl)thio]-6-methyl-pyrimidin-2-yl]azepane Formula: C17H23N5S MolecularWeight: 329.46302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC2=NC(=NC(=C2)C)N3CCCCCC3)C

Isomeric SMILES

CC1=CC(=NC(=N1)SC2=NC(=NC(=C2)C)N3CCCCCC3)C

InChI

InChI=1S/C17H23N5S/c1-12-10-13(2)20-17(19-12)23-15-11-14(3)18-16(21-15)22-8-6-4-5-7-9-22/h10-11H,4-9H2,1-3H3