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

Systemtic Name: N-[6-azanyl-2-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl]-4-chloranyl-benzamide Openeye Name: N-[6-amino-2-[2-(4-fluoroanilino)-2-oxo-ethyl]sulfanyl-4-oxo-1H-pyrimidin-5-yl]-4-chloro-benzamide CAS Name: N-[6-amino-2-[[2-(4-fluoroanilino)-2-oxoethyl]thio]-4-oxo-1H-pyrimidin-5-yl]-4-chlorobenzamide IUPAC Name: N-[6-amino-2-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-4-oxo-1H-pyrimidin-5-yl]-4-chlorobenzamide Traditional Name: N-[6-amino-2-[[2-(4-fluoroanilino)-2-keto-ethyl]thio]-4-keto-1H-pyrimidin-5-yl]-4-chloro-benzamide Formula: C19H15ClFN5O3S MolecularWeight: 447.870503

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC2=C(NC(=NC2=O)SCC(=O)NC3=CC=C(C=C3)F)N)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC2=C(NC(=NC2=O)SCC(=O)NC3=CC=C(C=C3)F)N)Cl

InChI

InChI=1S/C19H15ClFN5O3S/c20-11-3-1-10(2-4-11)17(28)24-15-16(22)25-19(26-18(15)29)30-9-14(27)23-13-7-5-12(21)6-8-13/h1-8H,9H2,(H,23,27)(H,24,28)(H3,22,25,26,29)