4-[2-(5-cyano-2-cyclopropyl-6-methyl-pyrimidin-4-yl)sulfanylethanoylamino]-N,N-dimethyl-benzamide

Systemtic Name: 4-[2-(5-cyano-2-cyclopropyl-6-methyl-pyrimidin-4-yl)sulfanylethanoylamino]-N,N-dimethyl-benzamide Openeye Name: 4-[[2-(5-cyano-2-cyclopropyl-6-methyl-pyrimidin-4-yl)sulfanylacetyl]amino]-N,N-dimethyl-benzamide CAS Name: 4-[[2-[(5-cyano-2-cyclopropyl-6-methyl-4-pyrimidinyl)thio]-1-oxoethyl]amino]-N,N-dimethylbenzamide IUPAC Name: 4-[[2-(5-cyano-2-cyclopropyl-6-methylpyrimidin-4-yl)sulfanylacetyl]amino]-N,N-dimethylbenzamide Traditional Name: 4-[[2-[(5-cyano-2-cyclopropyl-6-methyl-pyrimidin-4-yl)thio]acetyl]amino]-N,N-dimethyl-benzamide Formula: C20H21N5O2S MolecularWeight: 395.47804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2CC2)SCC(=O)NC3=CC=C(C=C3)C(=O)N(C)C)C#N

Isomeric SMILES

CC1=C(C(=NC(=N1)C2CC2)SCC(=O)NC3=CC=C(C=C3)C(=O)N(C)C)C#N

InChI

InChI=1S/C20H21N5O2S/c1-12-16(10-21)19(24-18(22-12)13-4-5-13)28-11-17(26)23-15-8-6-14(7-9-15)20(27)25(2)3/h6-9,13H,4-5,11H2,1-3H3,(H,23,26)