2-chloranyl-4-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoylamino]-N,N-diethyl-benzamide

Systemtic Name: 2-chloranyl-4-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoylamino]-N,N-diethyl-benzamide Openeye Name: 2-chloro-4-[[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]amino]-N,N-diethyl-benzamide CAS Name: 2-chloro-4-[[2-[(4,6-dimethyl-2-pyrimidinyl)thio]-1-oxoethyl]amino]-N,N-diethylbenzamide IUPAC Name: 2-chloro-4-[[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]amino]-N,N-diethylbenzamide Traditional Name: 2-chloro-4-[[2-[(4,6-dimethylpyrimidin-2-yl)thio]acetyl]amino]-N,N-diethyl-benzamide Formula: C19H23ClN4O2S MolecularWeight: 406.92952

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C=C(C=C1)NC(=O)CSC2=NC(=CC(=N2)C)C)Cl

Isomeric SMILES

CCN(CC)C(=O)C1=C(C=C(C=C1)NC(=O)CSC2=NC(=CC(=N2)C)C)Cl

InChI

InChI=1S/C19H23ClN4O2S/c1-5-24(6-2)18(26)15-8-7-14(10-16(15)20)23-17(25)11-27-19-21-12(3)9-13(4)22-19/h7-10H,5-6,11H2,1-4H3,(H,23,25)