1-(3-ethylphenyl)-3-[(4S)-6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl]thiourea

Systemtic Name: 1-(3-ethylphenyl)-3-[(4S)-6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl]thiourea Openeye Name: 1-(3-ethylphenyl)-3-[(4S)-6-fluorothiochroman-4-yl]thiourea CAS Name: 1-(3-ethylphenyl)-3-[(4S)-6-fluoro-3,4-dihydro-2H-1-benzothiopyran-4-yl]thiourea IUPAC Name: 1-(3-ethylphenyl)-3-[(4S)-6-fluoro-3,4-dihydro-2H-thiochromen-4-yl]thiourea Traditional Name: 1-(3-ethylphenyl)-3-[(4S)-6-fluorothiochroman-4-yl]thiourea Formula: C18H19FN2S2 MolecularWeight: 346.485263

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=S)NC2CCSC3=C2C=C(C=C3)F

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=S)N[C@H]2CCSC3=C2C=C(C=C3)F

InChI

InChI=1S/C18H19FN2S2/c1-2-12-4-3-5-14(10-12)20-18(22)21-16-8-9-23-17-7-6-13(19)11-15(16)17/h3-7,10-11,16H,2,8-9H2,1H3,(H2,20,21,22)/t16-/m0/s1