N-[4-[2-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)sulfanylethanoyl]phenyl]methanesulfonamide

Systemtic Name: N-[4-[2-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)sulfanylethanoyl]phenyl]methanesulfonamide Openeye Name: N-[4-[2-(2-isopropyl-6-methyl-pyrimidin-4-yl)sulfanylacetyl]phenyl]methanesulfonamide CAS Name: N-[4-[2-[(6-methyl-2-propan-2-yl-4-pyrimidinyl)thio]-1-oxoethyl]phenyl]methanesulfonamide IUPAC Name: N-[4-[2-(6-methyl-2-propan-2-ylpyrimidin-4-yl)sulfanylacetyl]phenyl]methanesulfonamide Traditional Name: N-[4-[2-[(2-isopropyl-6-methyl-pyrimidin-4-yl)thio]acetyl]phenyl]methanesulfonamide Formula: C17H21N3O3S2 MolecularWeight: 379.49694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C(C)C)SCC(=O)C2=CC=C(C=C2)NS(=O)(=O)C

Isomeric SMILES

CC1=CC(=NC(=N1)C(C)C)SCC(=O)C2=CC=C(C=C2)NS(=O)(=O)C

InChI

InChI=1S/C17H21N3O3S2/c1-11(2)17-18-12(3)9-16(19-17)24-10-15(21)13-5-7-14(8-6-13)20-25(4,22)23/h5-9,11,20H,10H2,1-4H3