N-(3-pyrrolidin-1-ylsulfonylphenyl)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-pyrrolidin-1-ylsulfonylphenyl)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-(3-pyrrolidin-1-ylsulfonylphenyl)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-[3-(1-pyrrolidinylsulfonyl)phenyl]-2-[(4,5,6-trimethyl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-(3-pyrrolidin-1-ylsulfonylphenyl)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-(3-pyrrolidinosulfonylphenyl)-2-[(4,5,6-trimethylpyrimidin-2-yl)thio]acetamide Formula: C19H24N4O3S2 MolecularWeight: 420.54886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1C)SCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3)C

Isomeric SMILES

CC1=C(N=C(N=C1C)SCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3)C

InChI

InChI=1S/C19H24N4O3S2/c1-13-14(2)20-19(21-15(13)3)27-12-18(24)22-16-7-6-8-17(11-16)28(25,26)23-9-4-5-10-23/h6-8,11H,4-5,9-10,12H2,1-3H3,(H,22,24)