1,3-dimethyl-5-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]sulfonyl-pyrimidine-2,4-dione

Systemtic Name: 1,3-dimethyl-5-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]sulfonyl-pyrimidine-2,4-dione Openeye Name: 1,3-dimethyl-5-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]sulfonyl-pyrimidine-2,4-dione CAS Name: 1,3-dimethyl-5-[[(2R)-2-(1-methyl-2-pyrrolyl)-1-azepanyl]sulfonyl]pyrimidine-2,4-dione IUPAC Name: 1,3-dimethyl-5-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]sulfonylpyrimidine-2,4-dione Traditional Name: 1,3-dimethyl-5-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]sulfonyl-pyrimidine-2,4-quinone Formula: C17H24N4O4S MolecularWeight: 380.46186

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C2CCCCCN2S(=O)(=O)C3=CN(C(=O)N(C3=O)C)C

Isomeric SMILES

CN1C=CC=C1[C@H]2CCCCCN2S(=O)(=O)C3=CN(C(=O)N(C3=O)C)C

InChI

InChI=1S/C17H24N4O4S/c1-18-10-7-9-13(18)14-8-5-4-6-11-21(14)26(24,25)15-12-19(2)17(23)20(3)16(15)22/h7,9-10,12,14H,4-6,8,11H2,1-3H3/t14-/m1/s1