2-[4-(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)carbonyl-1,4-diazepan-1-yl]-N,N-dimethyl-ethanamide

Systemtic Name: 2-[4-(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)carbonyl-1,4-diazepan-1-yl]-N,N-dimethyl-ethanamide Openeye Name: 2-[4-(5-chloro-2-methylsulfanyl-pyrimidine-4-carbonyl)-1,4-diazepan-1-yl]-N,N-dimethyl-acetamide CAS Name: 2-[4-[[5-chloro-2-(methylthio)-4-pyrimidinyl]-oxomethyl]-1,4-diazepan-1-yl]-N,N-dimethylacetamide IUPAC Name: 2-[4-(5-chloro-2-methylsulfanylpyrimidine-4-carbonyl)-1,4-diazepan-1-yl]-N,N-dimethylacetamide Traditional Name: 2-[4-[5-chloro-2-(methylthio)pyrimidine-4-carbonyl]-1,4-diazepan-1-yl]-N,N-dimethyl-acetamide Formula: C15H22ClN5O2S MolecularWeight: 371.88548

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CN1CCCN(CC1)C(=O)C2=NC(=NC=C2Cl)SC

Isomeric SMILES

CN(C)C(=O)CN1CCCN(CC1)C(=O)C2=NC(=NC=C2Cl)SC

InChI

InChI=1S/C15H22ClN5O2S/c1-19(2)12(22)10-20-5-4-6-21(8-7-20)14(23)13-11(16)9-17-15(18-13)24-3/h9H,4-8,10H2,1-3H3