3-[[4,5-dimethyl-6-(4-methylpiperazin-1-yl)pyrimidin-2-yl]sulfanylmethyl]-N-(2-methoxyethyl)benzamide

Systemtic Name: 3-[[4,5-dimethyl-6-(4-methylpiperazin-1-yl)pyrimidin-2-yl]sulfanylmethyl]-N-(2-methoxyethyl)benzamide Openeye Name: 3-[[4,5-dimethyl-6-(4-methylpiperazin-1-yl)pyrimidin-2-yl]sulfanylmethyl]-N-(2-methoxyethyl)benzamide CAS Name: 3-[[[4,5-dimethyl-6-(4-methyl-1-piperazinyl)-2-pyrimidinyl]thio]methyl]-N-(2-methoxyethyl)benzamide IUPAC Name: 3-[[4,5-dimethyl-6-(4-methylpiperazin-1-yl)pyrimidin-2-yl]sulfanylmethyl]-N-(2-methoxyethyl)benzamide Traditional Name: 3-[[[4,5-dimethyl-6-(4-methylpiperazino)pyrimidin-2-yl]thio]methyl]-N-(2-methoxyethyl)benzamide Formula: C22H31N5O2S MolecularWeight: 429.57884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1N2CCN(CC2)C)SCC3=CC=CC(=C3)C(=O)NCCOC)C

Isomeric SMILES

CC1=C(N=C(N=C1N2CCN(CC2)C)SCC3=CC=CC(=C3)C(=O)NCCOC)C

InChI

InChI=1S/C22H31N5O2S/c1-16-17(2)24-22(25-20(16)27-11-9-26(3)10-12-27)30-15-18-6-5-7-19(14-18)21(28)23-8-13-29-4/h5-7,14H,8-13,15H2,1-4H3,(H,23,28)