N-[(Z)-(6-fluoranyl-2,3-dihydrothiochromen-4-ylidene)amino]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide

Systemtic Name: N-[(Z)-(6-fluoranyl-2,3-dihydrothiochromen-4-ylidene)amino]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide Openeye Name: N-[(Z)-(6-fluorothiochroman-4-ylidene)amino]-3-isopropyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(Z)-(6-fluoro-2,3-dihydro-1-benzothiopyran-4-ylidene)amino]-4-oxo-3-propan-2-yl-1-phthalazinecarboxamide IUPAC Name: N-[(Z)-(6-fluoro-2,3-dihydrothiochromen-4-ylidene)amino]-4-oxo-3-propan-2-ylphthalazine-1-carboxamide Traditional Name: N-[(Z)-(6-fluorothiochroman-4-ylidene)amino]-3-isopropyl-4-keto-phthalazine-1-carboxamide Formula: C21H19FN4O2S MolecularWeight: 410.464563

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=C3CCSC4=C3C=C(C=C4)F

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C\3/CCSC4=C3C=C(C=C4)F

InChI

InChI=1S/C21H19FN4O2S/c1-12(2)26-21(28)15-6-4-3-5-14(15)19(25-26)20(27)24-23-17-9-10-29-18-8-7-13(22)11-16(17)18/h3-8,11-12H,9-10H2,1-2H3,(H,24,27)/b23-17-