3-[(6R)-3-(2-methoxyphenyl)-4-methyl-5-morpholin-4-ylcarbonyl-2-sulfanylidene-1,6-dihydropyrimidin-6-yl]benzenecarbonitrile

Systemtic Name: 3-[(6R)-3-(2-methoxyphenyl)-4-methyl-5-morpholin-4-ylcarbonyl-2-sulfanylidene-1,6-dihydropyrimidin-6-yl]benzenecarbonitrile Openeye Name: 3-[(6R)-3-(2-methoxyphenyl)-4-methyl-5-(morpholine-4-carbonyl)-2-thioxo-1,6-dihydropyrimidin-6-yl]benzonitrile CAS Name: 3-[(6R)-3-(2-methoxyphenyl)-4-methyl-5-[4-morpholinyl(oxo)methyl]-2-sulfanylidene-1,6-dihydropyrimidin-6-yl]benzonitrile IUPAC Name: 3-[(6R)-3-(2-methoxyphenyl)-4-methyl-5-(morpholine-4-carbonyl)-2-sulfanylidene-1,6-dihydropyrimidin-6-yl]benzonitrile Traditional Name: 3-[(6R)-3-(2-methoxyphenyl)-4-methyl-5-(morpholine-4-carbonyl)-2-thioxo-1,6-dihydropyrimidin-6-yl]benzonitrile Formula: C24H24N4O3S MolecularWeight: 448.53736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1C2=CC=CC=C2OC)C3=CC=CC(=C3)C#N)C(=O)N4CCOCC4

Isomeric SMILES

CC1=C([C@H](NC(=S)N1C2=CC=CC=C2OC)C3=CC=CC(=C3)C#N)C(=O)N4CCOCC4

InChI

InChI=1S/C24H24N4O3S/c1-16-21(23(29)27-10-12-31-13-11-27)22(18-7-5-6-17(14-18)15-25)26-24(32)28(16)19-8-3-4-9-20(19)30-2/h3-9,14,22H,10-13H2,1-2H3,(H,26,32)/t22-/m1/s1