3-[(3,5-dimethylphenyl)methyl]-1-(2,2-diphenylethyl)-4-sulfanylidene-pyrimidin-2-one

Systemtic Name: 3-[(3,5-dimethylphenyl)methyl]-1-(2,2-diphenylethyl)-4-sulfanylidene-pyrimidin-2-one Openeye Name: 3-[(3,5-dimethylphenyl)methyl]-1-(2,2-diphenylethyl)-4-thioxo-pyrimidin-2-one CAS Name: 3-[(3,5-dimethylphenyl)methyl]-1-(2,2-diphenylethyl)-4-sulfanylidene-2-pyrimidinone IUPAC Name: 3-[(3,5-dimethylphenyl)methyl]-1-(2,2-diphenylethyl)-4-sulfanylidenepyrimidin-2-one Traditional Name: 3-(3,5-dimethylbenzyl)-1-(2,2-diphenylethyl)-4-thioxo-pyrimidin-2-one Formula: C27H26N2OS MolecularWeight: 426.57314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)CN2C(=S)C=CN(C2=O)CC(C3=CC=CC=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=CC(=C1)CN2C(=S)C=CN(C2=O)CC(C3=CC=CC=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C27H26N2OS/c1-20-15-21(2)17-22(16-20)18-29-26(31)13-14-28(27(29)30)19-25(23-9-5-3-6-10-23)24-11-7-4-8-12-24/h3-17,25H,18-19H2,1-2H3