N-cyclopropyl-3-[[4-[4-(2-fluorophenyl)piperazin-1-yl]-6-methyl-pyrimidin-2-yl]sulfanylmethyl]benzamide

Systemtic Name: N-cyclopropyl-3-[[4-[4-(2-fluorophenyl)piperazin-1-yl]-6-methyl-pyrimidin-2-yl]sulfanylmethyl]benzamide Openeye Name: N-cyclopropyl-3-[[4-[4-(2-fluorophenyl)piperazin-1-yl]-6-methyl-pyrimidin-2-yl]sulfanylmethyl]benzamide CAS Name: N-cyclopropyl-3-[[[4-[4-(2-fluorophenyl)-1-piperazinyl]-6-methyl-2-pyrimidinyl]thio]methyl]benzamide IUPAC Name: N-cyclopropyl-3-[[4-[4-(2-fluorophenyl)piperazin-1-yl]-6-methylpyrimidin-2-yl]sulfanylmethyl]benzamide Traditional Name: N-cyclopropyl-3-[[[4-[4-(2-fluorophenyl)piperazino]-6-methyl-pyrimidin-2-yl]thio]methyl]benzamide Formula: C26H28FN5OS MolecularWeight: 477.596823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=CC=CC(=C2)C(=O)NC3CC3)N4CCN(CC4)C5=CC=CC=C5F

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=CC=CC(=C2)C(=O)NC3CC3)N4CCN(CC4)C5=CC=CC=C5F

InChI

InChI=1S/C26H28FN5OS/c1-18-15-24(32-13-11-31(12-14-32)23-8-3-2-7-22(23)27)30-26(28-18)34-17-19-5-4-6-20(16-19)25(33)29-21-9-10-21/h2-8,15-16,21H,9-14,17H2,1H3,(H,29,33)