2-(dimethylamino)-N-[3-oxidanyl-3-[3-(thiophen-2-ylcarbonylamino)phenyl]propyl]-4-phenyl-pyrimidine-5-carboxamide

Systemtic Name: 2-(dimethylamino)-N-[3-oxidanyl-3-[3-(thiophen-2-ylcarbonylamino)phenyl]propyl]-4-phenyl-pyrimidine-5-carboxamide Openeye Name: 2-(dimethylamino)-N-[3-hydroxy-3-[3-(thiophene-2-carbonylamino)phenyl]propyl]-4-phenyl-pyrimidine-5-carboxamide CAS Name: 2-(dimethylamino)-N-[3-hydroxy-3-[3-[[oxo(thiophen-2-yl)methyl]amino]phenyl]propyl]-4-phenyl-5-pyrimidinecarboxamide IUPAC Name: 2-(dimethylamino)-N-[3-hydroxy-3-[3-(thiophene-2-carbonylamino)phenyl]propyl]-4-phenylpyrimidine-5-carboxamide Traditional Name: 2-(dimethylamino)-N-[3-hydroxy-3-[3-(2-thenoylamino)phenyl]propyl]-4-phenyl-pyrimidine-5-carboxamide Formula: C27H27N5O3S MolecularWeight: 501.59998

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC=C(C(=N1)C2=CC=CC=C2)C(=O)NCCC(C3=CC(=CC=C3)NC(=O)C4=CC=CS4)O

Isomeric SMILES

CN(C)C1=NC=C(C(=N1)C2=CC=CC=C2)C(=O)NCCC(C3=CC(=CC=C3)NC(=O)C4=CC=CS4)O

InChI

InChI=1S/C27H27N5O3S/c1-32(2)27-29-17-21(24(31-27)18-8-4-3-5-9-18)25(34)28-14-13-22(33)19-10-6-11-20(16-19)30-26(35)23-12-7-15-36-23/h3-12,15-17,22,33H,13-14H2,1-2H3,(H,28,34)(H,30,35)