N-(6-fluoranyl-1,3-benzothiazol-2-yl)-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide

Systemtic Name: N-(6-fluoranyl-1,3-benzothiazol-2-yl)-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide Openeye Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-3-isopropyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-4-oxo-3-propan-2-yl-1-phthalazinecarboxamide IUPAC Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-4-oxo-3-propan-2-ylphthalazine-1-carboxamide Traditional Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-3-isopropyl-4-keto-phthalazine-1-carboxamide Formula: C19H15FN4O2S MolecularWeight: 382.411403

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC4=C(S3)C=C(C=C4)F

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC4=C(S3)C=C(C=C4)F

InChI

InChI=1S/C19H15FN4O2S/c1-10(2)24-18(26)13-6-4-3-5-12(13)16(23-24)17(25)22-19-21-14-8-7-11(20)9-15(14)27-19/h3-10H,1-2H3,(H,21,22,25)