5-chloranyl-N-[(4-methoxyphenyl)methyl]-2-[(3-methylphenyl)methylsulfonyl]pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-[(4-methoxyphenyl)methyl]-2-[(3-methylphenyl)methylsulfonyl]pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-[(4-methoxyphenyl)methyl]-2-(m-tolylmethylsulfonyl)pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[(4-methoxyphenyl)methyl]-2-[(3-methylphenyl)methylsulfonyl]-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-[(4-methoxyphenyl)methyl]-2-[(3-methylphenyl)methylsulfonyl]pyrimidine-4-carboxamide Traditional Name: 5-chloro-2-(3-methylbenzyl)sulfonyl-N-p-anisyl-pyrimidine-4-carboxamide Formula: C21H20ClN3O4S MolecularWeight: 445.9192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CS(=O)(=O)C2=NC=C(C(=N2)C(=O)NCC3=CC=C(C=C3)OC)Cl

Isomeric SMILES

CC1=CC(=CC=C1)CS(=O)(=O)C2=NC=C(C(=N2)C(=O)NCC3=CC=C(C=C3)OC)Cl

InChI

InChI=1S/C21H20ClN3O4S/c1-14-4-3-5-16(10-14)13-30(27,28)21-24-12-18(22)19(25-21)20(26)23-11-15-6-8-17(29-2)9-7-15/h3-10,12H,11,13H2,1-2H3,(H,23,26)