2-[2-[(3-chlorophenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]-N-(3,3-diphenylpropyl)ethanamide

Systemtic Name: 2-[2-[(3-chlorophenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]-N-(3,3-diphenylpropyl)ethanamide Openeye Name: 2-[2-[(3-chlorophenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]-N-(3,3-diphenylpropyl)acetamide CAS Name: 2-[2-[(3-chlorophenyl)methylthio]-4-oxo-1H-pyrimidin-6-yl]-N-(3,3-diphenylpropyl)acetamide IUPAC Name: 2-[2-[(3-chlorophenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]-N-(3,3-diphenylpropyl)acetamide Traditional Name: 2-[2-[(3-chlorobenzyl)thio]-4-keto-1H-pyrimidin-6-yl]-N-(3,3-diphenylpropyl)acetamide Formula: C28H26ClN3O2S MolecularWeight: 504.04294

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCNC(=O)CC2=CC(=O)N=C(N2)SCC3=CC(=CC=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(CCNC(=O)CC2=CC(=O)N=C(N2)SCC3=CC(=CC=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C28H26ClN3O2S/c29-23-13-7-8-20(16-23)19-35-28-31-24(18-27(34)32-28)17-26(33)30-15-14-25(21-9-3-1-4-10-21)22-11-5-2-6-12-22/h1-13,16,18,25H,14-15,17,19H2,(H,30,33)(H,31,32,34)