1-(4-chlorophenyl)-N-[(4S)-6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl]-6-methyl-4-oxidanylidene-pyridazine-3-carboxamide

Systemtic Name: 1-(4-chlorophenyl)-N-[(4S)-6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl]-6-methyl-4-oxidanylidene-pyridazine-3-carboxamide Openeye Name: 1-(4-chlorophenyl)-N-[(4S)-6-fluorothiochroman-4-yl]-6-methyl-4-oxo-pyridazine-3-carboxamide CAS Name: 1-(4-chlorophenyl)-N-[(4S)-6-fluoro-3,4-dihydro-2H-1-benzothiopyran-4-yl]-6-methyl-4-oxo-3-pyridazinecarboxamide IUPAC Name: 1-(4-chlorophenyl)-N-[(4S)-6-fluoro-3,4-dihydro-2H-thiochromen-4-yl]-6-methyl-4-oxopyridazine-3-carboxamide Traditional Name: 1-(4-chlorophenyl)-N-[(4S)-6-fluorothiochroman-4-yl]-4-keto-6-methyl-pyridazine-3-carboxamide Formula: C21H17ClFN3O2S MolecularWeight: 429.894983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=C(C=C2)Cl)C(=O)NC3CCSC4=C3C=C(C=C4)F

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=C(C=C2)Cl)C(=O)N[C@H]3CCSC4=C3C=C(C=C4)F

InChI

InChI=1S/C21H17ClFN3O2S/c1-12-10-18(27)20(25-26(12)15-5-2-13(22)3-6-15)21(28)24-17-8-9-29-19-7-4-14(23)11-16(17)19/h2-7,10-11,17H,8-9H2,1H3,(H,24,28)/t17-/m0/s1