4-(4-chloranylphthalazin-1-yl)-N-(6-fluoranyl-1,3-benzothiazol-2-yl)piperazine-1-carboxamide

Systemtic Name: 4-(4-chloranylphthalazin-1-yl)-N-(6-fluoranyl-1,3-benzothiazol-2-yl)piperazine-1-carboxamide Openeye Name: 4-(4-chlorophthalazin-1-yl)-N-(6-fluoro-1,3-benzothiazol-2-yl)piperazine-1-carboxamide CAS Name: 4-(4-chloro-1-phthalazinyl)-N-(6-fluoro-1,3-benzothiazol-2-yl)-1-piperazinecarboxamide IUPAC Name: 4-(4-chlorophthalazin-1-yl)-N-(6-fluoro-1,3-benzothiazol-2-yl)piperazine-1-carboxamide Traditional Name: 4-(4-chlorophthalazin-1-yl)-N-(6-fluoro-1,3-benzothiazol-2-yl)piperazine-1-carboxamide Formula: C20H16ClFN6OS MolecularWeight: 442.897043

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NN=C(C3=CC=CC=C32)Cl)C(=O)NC4=NC5=C(S4)C=C(C=C5)F

Isomeric SMILES

C1CN(CCN1C2=NN=C(C3=CC=CC=C32)Cl)C(=O)NC4=NC5=C(S4)C=C(C=C5)F

InChI

InChI=1S/C20H16ClFN6OS/c21-17-13-3-1-2-4-14(13)18(26-25-17)27-7-9-28(10-8-27)20(29)24-19-23-15-6-5-12(22)11-16(15)30-19/h1-6,11H,7-10H2,(H,23,24,29)