5-chloranyl-N-(4-ethoxyphenyl)-2-[(4-fluorophenyl)methylsulfonyl]-N-(phenylmethyl)pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-(4-ethoxyphenyl)-2-[(4-fluorophenyl)methylsulfonyl]-N-(phenylmethyl)pyrimidine-4-carboxamide Openeye Name: N-benzyl-5-chloro-N-(4-ethoxyphenyl)-2-[(4-fluorophenyl)methylsulfonyl]pyrimidine-4-carboxamide CAS Name: 5-chloro-N-(4-ethoxyphenyl)-2-[(4-fluorophenyl)methylsulfonyl]-N-(phenylmethyl)-4-pyrimidinecarboxamide IUPAC Name: N-benzyl-5-chloro-N-(4-ethoxyphenyl)-2-[(4-fluorophenyl)methylsulfonyl]pyrimidine-4-carboxamide Traditional Name: N-benzyl-5-chloro-2-(4-fluorobenzyl)sulfonyl-N-p-phenetyl-pyrimidine-4-carboxamide Formula: C27H23ClFN3O4S MolecularWeight: 540.005623

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(CC2=CC=CC=C2)C(=O)C3=NC(=NC=C3Cl)S(=O)(=O)CC4=CC=C(C=C4)F

Isomeric SMILES

CCOC1=CC=C(C=C1)N(CC2=CC=CC=C2)C(=O)C3=NC(=NC=C3Cl)S(=O)(=O)CC4=CC=C(C=C4)F

InChI

InChI=1S/C27H23ClFN3O4S/c1-2-36-23-14-12-22(13-15-23)32(17-19-6-4-3-5-7-19)26(33)25-24(28)16-30-27(31-25)37(34,35)18-20-8-10-21(29)11-9-20/h3-16H,2,17-18H2,1H3