1-(2,5-dimethoxyphenyl)-3-[(4S)-6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl]urea

Systemtic Name: 1-(2,5-dimethoxyphenyl)-3-[(4S)-6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl]urea Openeye Name: 1-(2,5-dimethoxyphenyl)-3-[(4S)-6-fluorothiochroman-4-yl]urea CAS Name: 1-(2,5-dimethoxyphenyl)-3-[(4S)-6-fluoro-3,4-dihydro-2H-1-benzothiopyran-4-yl]urea IUPAC Name: 1-(2,5-dimethoxyphenyl)-3-[(4S)-6-fluoro-3,4-dihydro-2H-thiochromen-4-yl]urea Traditional Name: 1-(2,5-dimethoxyphenyl)-3-[(4S)-6-fluorothiochroman-4-yl]urea Formula: C18H19FN2O3S MolecularWeight: 362.418463

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC(=O)NC2CCSC3=C2C=C(C=C3)F

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC(=O)N[C@H]2CCSC3=C2C=C(C=C3)F

InChI

InChI=1S/C18H19FN2O3S/c1-23-12-4-5-16(24-2)15(10-12)21-18(22)20-14-7-8-25-17-6-3-11(19)9-13(14)17/h3-6,9-10,14H,7-8H2,1-2H3,(H2,20,21,22)/t14-/m0/s1