N-[4-(4-butan-2-ylphenyl)-1,3-thiazol-2-yl]-3-(2,6-dimethyl-4-oxidanylidene-1H-pyrimidin-5-yl)propanamide

Systemtic Name: N-[4-(4-butan-2-ylphenyl)-1,3-thiazol-2-yl]-3-(2,6-dimethyl-4-oxidanylidene-1H-pyrimidin-5-yl)propanamide Openeye Name: 3-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)-N-[4-(4-sec-butylphenyl)thiazol-2-yl]propanamide CAS Name: N-[4-(4-butan-2-ylphenyl)-2-thiazolyl]-3-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)propanamide IUPAC Name: N-[4-(4-butan-2-ylphenyl)-1,3-thiazol-2-yl]-3-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)propanamide Traditional Name: 3-(4-keto-2,6-dimethyl-1H-pyrimidin-5-yl)-N-[4-(4-sec-butylphenyl)thiazol-2-yl]propionamide Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CCC3=C(NC(=NC3=O)C)C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CCC3=C(NC(=NC3=O)C)C

InChI

InChI=1S/C22H26N4O2S/c1-5-13(2)16-6-8-17(9-7-16)19-12-29-22(25-19)26-20(27)11-10-18-14(3)23-15(4)24-21(18)28/h6-9,12-13H,5,10-11H2,1-4H3,(H,23,24,28)(H,25,26,27)