N-[6-azanyl-2-[(3-fluorophenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-5-yl]-4-chloranyl-benzamide

Systemtic Name: N-[6-azanyl-2-[(3-fluorophenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-5-yl]-4-chloranyl-benzamide Openeye Name: N-[6-amino-2-[(3-fluorophenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-5-yl]-4-chloro-benzamide CAS Name: N-[6-amino-2-[(3-fluorophenyl)methylthio]-4-oxo-1H-pyrimidin-5-yl]-4-chlorobenzamide IUPAC Name: N-[6-amino-2-[(3-fluorophenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-5-yl]-4-chlorobenzamide Traditional Name: N-[6-amino-2-[(3-fluorobenzyl)thio]-4-keto-1H-pyrimidin-5-yl]-4-chloro-benzamide Formula: C18H14ClFN4O2S MolecularWeight: 404.845763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14ClFN4O2S/c19-12-6-4-11(5-7-12)16(25)22-14-15(21)23-18(24-17(14)26)27-9-10-2-1-3-13(20)8-10/h1-8H,9H2,(H,22,25)(H3,21,23,24,26)