5-chloranyl-2-[(3-methylphenyl)methylsulfonyl]-N-(4-morpholin-4-ylsulfonylphenyl)pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-2-[(3-methylphenyl)methylsulfonyl]-N-(4-morpholin-4-ylsulfonylphenyl)pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-(4-morpholinosulfonylphenyl)-2-(m-tolylmethylsulfonyl)pyrimidine-4-carboxamide CAS Name: 5-chloro-2-[(3-methylphenyl)methylsulfonyl]-N-[4-(4-morpholinylsulfonyl)phenyl]-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-2-[(3-methylphenyl)methylsulfonyl]-N-(4-morpholin-4-ylsulfonylphenyl)pyrimidine-4-carboxamide Traditional Name: 5-chloro-2-(3-methylbenzyl)sulfonyl-N-(4-morpholinosulfonylphenyl)pyrimidine-4-carboxamide Formula: C23H23ClN4O6S2 MolecularWeight: 551.03492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CS(=O)(=O)C2=NC=C(C(=N2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)Cl

Isomeric SMILES

CC1=CC(=CC=C1)CS(=O)(=O)C2=NC=C(C(=N2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)Cl

InChI

InChI=1S/C23H23ClN4O6S2/c1-16-3-2-4-17(13-16)15-35(30,31)23-25-14-20(24)21(27-23)22(29)26-18-5-7-19(8-6-18)36(32,33)28-9-11-34-12-10-28/h2-8,13-14H,9-12,15H2,1H3,(H,26,29)