N-[6-azanyl-2-[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl]-4-chloranyl-benzamide

Systemtic Name: N-[6-azanyl-2-[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl]-4-chloranyl-benzamide Openeye Name: N-[6-amino-2-[2-[(4-fluorophenyl)methylamino]-2-oxo-ethyl]sulfanyl-4-oxo-1H-pyrimidin-5-yl]-4-chloro-benzamide CAS Name: N-[6-amino-2-[[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]thio]-4-oxo-1H-pyrimidin-5-yl]-4-chlorobenzamide IUPAC Name: N-[6-amino-2-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]sulfanyl-4-oxo-1H-pyrimidin-5-yl]-4-chlorobenzamide Traditional Name: N-[6-amino-2-[[2-[(4-fluorobenzyl)amino]-2-keto-ethyl]thio]-4-keto-1H-pyrimidin-5-yl]-4-chloro-benzamide Formula: C20H17ClFN5O3S MolecularWeight: 461.897083

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)CSC2=NC(=O)C(=C(N2)N)NC(=O)C3=CC=C(C=C3)Cl)F

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)CSC2=NC(=O)C(=C(N2)N)NC(=O)C3=CC=C(C=C3)Cl)F

InChI

InChI=1S/C20H17ClFN5O3S/c21-13-5-3-12(4-6-13)18(29)25-16-17(23)26-20(27-19(16)30)31-10-15(28)24-9-11-1-7-14(22)8-2-11/h1-8H,9-10H2,(H,24,28)(H,25,29)(H3,23,26,27,30)