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

Systemtic Name: 2-[2-[(3-chlorophenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]-N-(pyridin-4-ylmethyl)ethanamide Openeye Name: 2-[2-[(3-chlorophenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]-N-(4-pyridylmethyl)acetamide CAS Name: 2-[2-[(3-chlorophenyl)methylthio]-4-oxo-1H-pyrimidin-6-yl]-N-(pyridin-4-ylmethyl)acetamide IUPAC Name: 2-[2-[(3-chlorophenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]-N-(pyridin-4-ylmethyl)acetamide Traditional Name: 2-[2-[(3-chlorobenzyl)thio]-4-keto-1H-pyrimidin-6-yl]-N-(4-pyridylmethyl)acetamide Formula: C19H17ClN4O2S MolecularWeight: 400.88188

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)CSC2=NC(=O)C=C(N2)CC(=O)NCC3=CC=NC=C3

Isomeric SMILES

C1=CC(=CC(=C1)Cl)CSC2=NC(=O)C=C(N2)CC(=O)NCC3=CC=NC=C3

InChI

InChI=1S/C19H17ClN4O2S/c20-15-3-1-2-14(8-15)12-27-19-23-16(10-18(26)24-19)9-17(25)22-11-13-4-6-21-7-5-13/h1-8,10H,9,11-12H2,(H,22,25)(H,23,24,26)