2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[4-(oxolan-2-ylmethylcarbamoylamino)phenyl]ethanamide

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[4-(oxolan-2-ylmethylcarbamoylamino)phenyl]ethanamide Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[4-(tetrahydrofuran-2-ylmethylcarbamoylamino)phenyl]acetamide CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]-N-[4-[[oxo-(2-oxolanylmethylamino)methyl]amino]phenyl]acetamide IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[4-(oxolan-2-ylmethylcarbamoylamino)phenyl]acetamide Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]-N-[4-(tetrahydrofurfurylcarbamoylamino)phenyl]acetamide Formula: C20H25N5O3S MolecularWeight: 415.5092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NC2=CC=C(C=C2)NC(=O)NCC3CCCO3)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NC2=CC=C(C=C2)NC(=O)NCC3CCCO3)C

InChI

InChI=1S/C20H25N5O3S/c1-13-10-14(2)23-20(22-13)29-12-18(26)24-15-5-7-16(8-6-15)25-19(27)21-11-17-4-3-9-28-17/h5-8,10,17H,3-4,9,11-12H2,1-2H3,(H,24,26)(H2,21,25,27)