1-[1-(2,5-dimethylphenyl)-6-methyl-4-pyrrolidin-1-yl-2-sulfanylidene-pyrimidin-5-yl]ethanone

Systemtic Name: 1-[1-(2,5-dimethylphenyl)-6-methyl-4-pyrrolidin-1-yl-2-sulfanylidene-pyrimidin-5-yl]ethanone Openeye Name: 1-[1-(2,5-dimethylphenyl)-6-methyl-4-pyrrolidin-1-yl-2-thioxo-pyrimidin-5-yl]ethanone CAS Name: 1-[1-(2,5-dimethylphenyl)-6-methyl-4-(1-pyrrolidinyl)-2-sulfanylidene-5-pyrimidinyl]ethanone IUPAC Name: 1-[1-(2,5-dimethylphenyl)-6-methyl-4-pyrrolidin-1-yl-2-sulfanylidenepyrimidin-5-yl]ethanone Traditional Name: 1-[1-(2,5-dimethylphenyl)-6-methyl-4-pyrrolidino-2-thioxo-pyrimidin-5-yl]ethanone Formula: C19H23N3OS MolecularWeight: 341.47042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C(=C(C(=NC2=S)N3CCCC3)C(=O)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C(=C(C(=NC2=S)N3CCCC3)C(=O)C)C

InChI

InChI=1S/C19H23N3OS/c1-12-7-8-13(2)16(11-12)22-14(3)17(15(4)23)18(20-19(22)24)21-9-5-6-10-21/h7-8,11H,5-6,9-10H2,1-4H3