(6S)-3-(3-fluoranyl-4-methyl-phenyl)-4-methyl-N-(5-methyl-1,2-oxazol-3-yl)-2-sulfanylidene-6-thiophen-2-yl-1,6-dihydropyrimidine-5-carboxamide

Systemtic Name: (6S)-3-(3-fluoranyl-4-methyl-phenyl)-4-methyl-N-(5-methyl-1,2-oxazol-3-yl)-2-sulfanylidene-6-thiophen-2-yl-1,6-dihydropyrimidine-5-carboxamide Openeye Name: (6S)-3-(3-fluoro-4-methyl-phenyl)-4-methyl-N-(5-methylisoxazol-3-yl)-6-(2-thienyl)-2-thioxo-1,6-dihydropyrimidine-5-carboxamide CAS Name: (6S)-3-(3-fluoro-4-methylphenyl)-4-methyl-N-(5-methyl-3-isoxazolyl)-2-sulfanylidene-6-thiophen-2-yl-1,6-dihydropyrimidine-5-carboxamide IUPAC Name: (6S)-3-(3-fluoro-4-methylphenyl)-4-methyl-N-(5-methyl-1,2-oxazol-3-yl)-2-sulfanylidene-6-thiophen-2-yl-1,6-dihydropyrimidine-5-carboxamide Traditional Name: (6S)-3-(3-fluoro-4-methyl-phenyl)-4-methyl-N-(5-methylisoxazol-3-yl)-6-(2-thienyl)-2-thioxo-1,6-dihydropyrimidine-5-carboxamide Formula: C21H19FN4O2S2 MolecularWeight: 442.529563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=C(C(NC2=S)C3=CC=CS3)C(=O)NC4=NOC(=C4)C)C)F

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=C([C@H](NC2=S)C3=CC=CS3)C(=O)NC4=NOC(=C4)C)C)F

InChI

InChI=1S/C21H19FN4O2S2/c1-11-6-7-14(10-15(11)22)26-13(3)18(20(27)23-17-9-12(2)28-25-17)19(24-21(26)29)16-5-4-8-30-16/h4-10,19H,1-3H3,(H,24,29)(H,23,25,27)/t19-/m1/s1