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2-[4-chloranyl-6-[4-(2-methylphenyl)piperazin-1-yl]pyrimidin-2-yl]sulfanyl-N-(3-methylbutan-2-yl)ethanamide

2-[4-chloranyl-6-[4-(2-methylphenyl)piperazin-1-yl]pyrimidin-2-yl]sulfanyl-N-(3-methylbutan-2-yl)ethanamide

Systemtic Name:2-[4-chloranyl-6-[4-(2-methylphenyl)piperazin-1-yl]pyrimidin-2-yl]sulfanyl-N-(3-methylbutan-2-yl)ethanamide
Openeye Name:2-[4-chloro-6-[4-(o-tolyl)piperazin-1-yl]pyrimidin-2-yl]sulfanyl-N-(1,2-dimethylpropyl)acetamide
CAS Name:2-[[4-chloro-6-[4-(2-methylphenyl)-1-piperazinyl]-2-pyrimidinyl]thio]-N-(3-methylbutan-2-yl)acetamide
IUPAC Name:2-[4-chloro-6-[4-(2-methylphenyl)piperazin-1-yl]pyrimidin-2-yl]sulfanyl-N-(3-methylbutan-2-yl)acetamide
Traditional Name:2-[[4-chloro-6-[4-(o-tolyl)piperazino]pyrimidin-2-yl]thio]-N-(1,2-dimethylpropyl)acetamide
Formula: C22H30ClN5OS
MolecularWeight: 448.0245
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)C3=CC(=NC(=N3)SCC(=O)NC(C)C(C)C)Cl


Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)C3=CC(=NC(=N3)SCC(=O)NC(C)C(C)C)Cl


InChI

InChI=1S/C22H30ClN5OS/c1-15(2)17(4)24-21(29)14-30-22-25-19(23)13-20(26-22)28-11-9-27(10-12-28)18-8-6-5-7-16(18)3/h5-8,13,15,17H,9-12,14H2,1-4H3,(H,24,29)


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