3-cyclopentyl-N-(2-methylpyrimidin-4-yl)-2-(4-methylsulfonyl-3-nitro-phenyl)propanamide

Systemtic Name: 3-cyclopentyl-N-(2-methylpyrimidin-4-yl)-2-(4-methylsulfonyl-3-nitro-phenyl)propanamide Openeye Name: 3-cyclopentyl-N-(2-methylpyrimidin-4-yl)-2-(4-methylsulfonyl-3-nitro-phenyl)propanamide CAS Name: 3-cyclopentyl-N-(2-methyl-4-pyrimidinyl)-2-(4-methylsulfonyl-3-nitrophenyl)propanamide IUPAC Name: 3-cyclopentyl-N-(2-methylpyrimidin-4-yl)-2-(4-methylsulfonyl-3-nitrophenyl)propanamide Traditional Name: 3-cyclopentyl-2-(4-mesyl-3-nitro-phenyl)-N-(2-methylpyrimidin-4-yl)propionamide Formula: C20H24N4O5S MolecularWeight: 432.49336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=N1)NC(=O)C(CC2CCCC2)C3=CC(=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=CC(=N1)NC(=O)C(CC2CCCC2)C3=CC(=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O5S/c1-13-21-10-9-19(22-13)23-20(25)16(11-14-5-3-4-6-14)15-7-8-18(30(2,28)29)17(12-15)24(26)27/h7-10,12,14,16H,3-6,11H2,1-2H3,(H,21,22,23,25)