2-[6-azanyl-1-(3-chlorophenyl)-4-oxidanylidene-pyrimidin-2-yl]sulfanyl-N-(4-fluorophenyl)ethanamide

Systemtic Name: 2-[6-azanyl-1-(3-chlorophenyl)-4-oxidanylidene-pyrimidin-2-yl]sulfanyl-N-(4-fluorophenyl)ethanamide Openeye Name: 2-[6-amino-1-(3-chlorophenyl)-4-oxo-pyrimidin-2-yl]sulfanyl-N-(4-fluorophenyl)acetamide CAS Name: 2-[[6-amino-1-(3-chlorophenyl)-4-oxo-2-pyrimidinyl]thio]-N-(4-fluorophenyl)acetamide IUPAC Name: 2-[6-amino-1-(3-chlorophenyl)-4-oxopyrimidin-2-yl]sulfanyl-N-(4-fluorophenyl)acetamide Traditional Name: 2-[[6-amino-1-(3-chlorophenyl)-4-keto-pyrimidin-2-yl]thio]-N-(4-fluorophenyl)acetamide Formula: C18H14ClFN4O2S MolecularWeight: 404.845763

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)N2C(=CC(=O)N=C2SCC(=O)NC3=CC=C(C=C3)F)N

Isomeric SMILES

C1=CC(=CC(=C1)Cl)N2C(=CC(=O)N=C2SCC(=O)NC3=CC=C(C=C3)F)N

InChI

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