3-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]carbonylbenzamide

Systemtic Name: 3-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]carbonylbenzamide Openeye Name: 3-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazine-1-carbonyl]benzamide CAS Name: 3-[[4-(6-methyl-2-propan-2-yl-4-pyrimidinyl)-1-piperazinyl]-oxomethyl]benzamide IUPAC Name: 3-[4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazine-1-carbonyl]benzamide Traditional Name: 3-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazine-1-carbonyl]benzamide Formula: C20H25N5O2 MolecularWeight: 367.4448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=O)C3=CC(=CC=C3)C(=O)N

Isomeric SMILES

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=O)C3=CC(=CC=C3)C(=O)N

InChI

InChI=1S/C20H25N5O2/c1-13(2)19-22-14(3)11-17(23-19)24-7-9-25(10-8-24)20(27)16-6-4-5-15(12-16)18(21)26/h4-6,11-13H,7-10H2,1-3H3,(H2,21,26)