N-cyclohexyl-4-(2-fluorophenyl)-N-(phenylmethyl)-2-thiomorpholin-4-yl-pyrimidine-5-carboxamide

Systemtic Name: N-cyclohexyl-4-(2-fluorophenyl)-N-(phenylmethyl)-2-thiomorpholin-4-yl-pyrimidine-5-carboxamide Openeye Name: N-benzyl-N-cyclohexyl-4-(2-fluorophenyl)-2-thiomorpholino-pyrimidine-5-carboxamide CAS Name: N-cyclohexyl-4-(2-fluorophenyl)-N-(phenylmethyl)-2-thiomorpholin-4-yl-5-pyrimidinecarboxamide IUPAC Name: N-benzyl-N-cyclohexyl-4-(2-fluorophenyl)-2-thiomorpholin-4-ylpyrimidine-5-carboxamide Traditional Name: N-benzyl-N-cyclohexyl-4-(2-fluorophenyl)-2-thiomorpholino-pyrimidine-5-carboxamide Formula: C28H31FN4OS MolecularWeight: 490.635343

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(CC2=CC=CC=C2)C(=O)C3=CN=C(N=C3C4=CC=CC=C4F)N5CCSCC5

Isomeric SMILES

C1CCC(CC1)N(CC2=CC=CC=C2)C(=O)C3=CN=C(N=C3C4=CC=CC=C4F)N5CCSCC5

InChI

InChI=1S/C28H31FN4OS/c29-25-14-8-7-13-23(25)26-24(19-30-28(31-26)32-15-17-35-18-16-32)27(34)33(22-11-5-2-6-12-22)20-21-9-3-1-4-10-21/h1,3-4,7-10,13-14,19,22H,2,5-6,11-12,15-18,20H2