[2-fluoranyl-4-(isoquinolin-4-ylamino)phenyl]-(4-methoxy-2-methyl-phenyl)methanethione

Systemtic Name: [2-fluoranyl-4-(isoquinolin-4-ylamino)phenyl]-(4-methoxy-2-methyl-phenyl)methanethione Openeye Name: [2-fluoro-4-(4-isoquinolylamino)phenyl]-(4-methoxy-2-methyl-phenyl)methanethione CAS Name: [2-fluoro-4-(4-isoquinolinylamino)phenyl]-(4-methoxy-2-methylphenyl)methanethione IUPAC Name: [2-fluoro-4-(isoquinolin-4-ylamino)phenyl]-(4-methoxy-2-methylphenyl)methanethione Traditional Name: [2-fluoro-4-(4-isoquinolylamino)phenyl]-(4-methoxy-2-methyl-phenyl)methanethione Formula: C24H19FN2OS MolecularWeight: 402.483863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC)C(=S)C2=C(C=C(C=C2)NC3=CN=CC4=CC=CC=C43)F

Isomeric SMILES

CC1=C(C=CC(=C1)OC)C(=S)C2=C(C=C(C=C2)NC3=CN=CC4=CC=CC=C43)F

InChI

InChI=1S/C24H19FN2OS/c1-15-11-18(28-2)8-10-19(15)24(29)21-9-7-17(12-22(21)25)27-23-14-26-13-16-5-3-4-6-20(16)23/h3-14,27H,1-2H3