1-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-3-[(3-fluoranyl-4-methyl-phenyl)methyl]urea

Systemtic Name: 1-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-3-[(3-fluoranyl-4-methyl-phenyl)methyl]urea Openeye Name: 1-[(3-fluoro-4-methyl-phenyl)methyl]-3-[(4S)-thiochroman-4-yl]urea CAS Name: 1-[(4S)-3,4-dihydro-2H-1-benzothiopyran-4-yl]-3-[(3-fluoro-4-methylphenyl)methyl]urea IUPAC Name: 1-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-3-[(3-fluoro-4-methylphenyl)methyl]urea Traditional Name: 1-(3-fluoro-4-methyl-benzyl)-3-[(4S)-thiochroman-4-yl]urea Formula: C18H19FN2OS MolecularWeight: 330.419663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CNC(=O)NC2CCSC3=CC=CC=C23)F

Isomeric SMILES

CC1=C(C=C(C=C1)CNC(=O)N[C@H]2CCSC3=CC=CC=C23)F

InChI

InChI=1S/C18H19FN2OS/c1-12-6-7-13(10-15(12)19)11-20-18(22)21-16-8-9-23-17-5-3-2-4-14(16)17/h2-7,10,16H,8-9,11H2,1H3,(H2,20,21,22)/t16-/m0/s1