1-methylsulfonyl-4-pyrimidin-2-yl-1,4-diazepane

Systemtic Name: 1-methylsulfonyl-4-pyrimidin-2-yl-1,4-diazepane Openeye Name: 1-methylsulfonyl-4-pyrimidin-2-yl-1,4-diazepane CAS Name: 1-methylsulfonyl-4-(2-pyrimidinyl)-1,4-diazepane IUPAC Name: 1-methylsulfonyl-4-pyrimidin-2-yl-1,4-diazepane Traditional Name: 1-mesyl-4-(2-pyrimidyl)-1,4-diazepane Formula: C10H16N4O2S MolecularWeight: 256.32464

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCN(CC1)C2=NC=CC=N2

Isomeric SMILES

CS(=O)(=O)N1CCCN(CC1)C2=NC=CC=N2

InChI

InChI=1S/C10H16N4O2S/c1-17(15,16)14-7-3-6-13(8-9-14)10-11-4-2-5-12-10/h2,4-5H,3,6-9H2,1H3