6-azanyl-5-[2-[5-(azepan-1-ylsulfonyl)pyridin-2-yl]sulfanylethanoyl]-1,3-dimethyl-pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-5-[2-[5-(azepan-1-ylsulfonyl)pyridin-2-yl]sulfanylethanoyl]-1,3-dimethyl-pyrimidine-2,4-dione Openeye Name: 6-amino-5-[2-[[5-(azepan-1-ylsulfonyl)-2-pyridyl]sulfanyl]acetyl]-1,3-dimethyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[2-[[5-(1-azepanylsulfonyl)-2-pyridinyl]thio]-1-oxoethyl]-1,3-dimethylpyrimidine-2,4-dione IUPAC Name: 6-amino-5-[2-[5-(azepan-1-ylsulfonyl)pyridin-2-yl]sulfanylacetyl]-1,3-dimethylpyrimidine-2,4-dione Traditional Name: 6-amino-5-[2-[[5-(azepan-1-ylsulfonyl)-2-pyridyl]thio]acetyl]-1,3-dimethyl-pyrimidine-2,4-quinone Formula: C19H25N5O5S2 MolecularWeight: 467.5623

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N(C1=O)C)C(=O)CSC2=NC=C(C=C2)S(=O)(=O)N3CCCCCC3)N

Isomeric SMILES

CN1C(=C(C(=O)N(C1=O)C)C(=O)CSC2=NC=C(C=C2)S(=O)(=O)N3CCCCCC3)N

InChI

InChI=1S/C19H25N5O5S2/c1-22-17(20)16(18(26)23(2)19(22)27)14(25)12-30-15-8-7-13(11-21-15)31(28,29)24-9-5-3-4-6-10-24/h7-8,11H,3-6,9-10,12,20H2,1-2H3