N-[(4-tert-butylphenyl)methyl]-N-cyclopropyl-4-(2-fluorophenyl)-2-thiomorpholin-4-yl-pyrimidine-5-carboxamide

Systemtic Name: N-[(4-tert-butylphenyl)methyl]-N-cyclopropyl-4-(2-fluorophenyl)-2-thiomorpholin-4-yl-pyrimidine-5-carboxamide Openeye Name: N-[(4-tert-butylphenyl)methyl]-N-cyclopropyl-4-(2-fluorophenyl)-2-thiomorpholino-pyrimidine-5-carboxamide CAS Name: N-[(4-tert-butylphenyl)methyl]-N-cyclopropyl-4-(2-fluorophenyl)-2-thiomorpholin-4-yl-5-pyrimidinecarboxamide IUPAC Name: N-[(4-tert-butylphenyl)methyl]-N-cyclopropyl-4-(2-fluorophenyl)-2-thiomorpholin-4-ylpyrimidine-5-carboxamide Traditional Name: N-(4-tert-butylbenzyl)-N-cyclopropyl-4-(2-fluorophenyl)-2-thiomorpholino-pyrimidine-5-carboxamide Formula: C29H33FN4OS MolecularWeight: 504.661923

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN(C2CC2)C(=O)C3=CN=C(N=C3C4=CC=CC=C4F)N5CCSCC5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN(C2CC2)C(=O)C3=CN=C(N=C3C4=CC=CC=C4F)N5CCSCC5

InChI

InChI=1S/C29H33FN4OS/c1-29(2,3)21-10-8-20(9-11-21)19-34(22-12-13-22)27(35)24-18-31-28(33-14-16-36-17-15-33)32-26(24)23-6-4-5-7-25(23)30/h4-11,18,22H,12-17,19H2,1-3H3