2-(3,4-dimethoxyphenyl)-N-[(4S)-6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-(3,4-dimethoxyphenyl)-N-[(4S)-6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl]-1,3-thiazole-4-carboxamide Openeye Name: 2-(3,4-dimethoxyphenyl)-N-[(4S)-6-fluorothiochroman-4-yl]thiazole-4-carboxamide CAS Name: 2-(3,4-dimethoxyphenyl)-N-[(4S)-6-fluoro-3,4-dihydro-2H-1-benzothiopyran-4-yl]-4-thiazolecarboxamide IUPAC Name: 2-(3,4-dimethoxyphenyl)-N-[(4S)-6-fluoro-3,4-dihydro-2H-thiochromen-4-yl]-1,3-thiazole-4-carboxamide Traditional Name: 2-(3,4-dimethoxyphenyl)-N-[(4S)-6-fluorothiochroman-4-yl]thiazole-4-carboxamide Formula: C21H19FN2O3S2 MolecularWeight: 430.515563

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=CS2)C(=O)NC3CCSC4=C3C=C(C=C4)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=CS2)C(=O)N[C@H]3CCSC4=C3C=C(C=C4)F)OC

InChI

InChI=1S/C21H19FN2O3S2/c1-26-17-5-3-12(9-18(17)27-2)21-24-16(11-29-21)20(25)23-15-7-8-28-19-6-4-13(22)10-14(15)19/h3-6,9-11,15H,7-8H2,1-2H3,(H,23,25)/t15-/m0/s1