4-[[4-chloranyl-6-(4-methylpiperazin-1-yl)pyrimidin-2-yl]sulfanylmethyl]-N-(phenylmethyl)benzamide

Systemtic Name: 4-[[4-chloranyl-6-(4-methylpiperazin-1-yl)pyrimidin-2-yl]sulfanylmethyl]-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-4-[[4-chloro-6-(4-methylpiperazin-1-yl)pyrimidin-2-yl]sulfanylmethyl]benzamide CAS Name: 4-[[[4-chloro-6-(4-methyl-1-piperazinyl)-2-pyrimidinyl]thio]methyl]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-4-[[4-chloro-6-(4-methylpiperazin-1-yl)pyrimidin-2-yl]sulfanylmethyl]benzamide Traditional Name: N-benzyl-4-[[[4-chloro-6-(4-methylpiperazino)pyrimidin-2-yl]thio]methyl]benzamide Formula: C24H26ClN5OS MolecularWeight: 468.01414

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC(=NC(=N2)SCC3=CC=C(C=C3)C(=O)NCC4=CC=CC=C4)Cl

Isomeric SMILES

CN1CCN(CC1)C2=CC(=NC(=N2)SCC3=CC=C(C=C3)C(=O)NCC4=CC=CC=C4)Cl

InChI

InChI=1S/C24H26ClN5OS/c1-29-11-13-30(14-12-29)22-15-21(25)27-24(28-22)32-17-19-7-9-20(10-8-19)23(31)26-16-18-5-3-2-4-6-18/h2-10,15H,11-14,16-17H2,1H3,(H,26,31)