[(6R)-3-(3,4-dimethylphenyl)-4-methyl-2-sulfanylidene-6-thiophen-3-yl-1,6-dihydropyrimidin-5-yl]-morpholin-4-yl-methanone

Systemtic Name: [(6R)-3-(3,4-dimethylphenyl)-4-methyl-2-sulfanylidene-6-thiophen-3-yl-1,6-dihydropyrimidin-5-yl]-morpholin-4-yl-methanone Openeye Name: [(6R)-3-(3,4-dimethylphenyl)-4-methyl-6-(3-thienyl)-2-thioxo-1,6-dihydropyrimidin-5-yl]-morpholino-methanone CAS Name: [(6R)-3-(3,4-dimethylphenyl)-4-methyl-2-sulfanylidene-6-(3-thiophenyl)-1,6-dihydropyrimidin-5-yl]-(4-morpholinyl)methanone IUPAC Name: [(6R)-3-(3,4-dimethylphenyl)-4-methyl-2-sulfanylidene-6-thiophen-3-yl-1,6-dihydropyrimidin-5-yl]-morpholin-4-ylmethanone Traditional Name: [(6R)-3-(3,4-dimethylphenyl)-4-methyl-6-(3-thienyl)-2-thioxo-1,6-dihydropyrimidin-5-yl]-morpholino-methanone Formula: C22H25N3O2S2 MolecularWeight: 427.5828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=C(C(NC2=S)C3=CSC=C3)C(=O)N4CCOCC4)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=C([C@@H](NC2=S)C3=CSC=C3)C(=O)N4CCOCC4)C)C

InChI

InChI=1S/C22H25N3O2S2/c1-14-4-5-18(12-15(14)2)25-16(3)19(21(26)24-7-9-27-10-8-24)20(23-22(25)28)17-6-11-29-13-17/h4-6,11-13,20H,7-10H2,1-3H3,(H,23,28)/t20-/m0/s1