1-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-3-[(4-fluorophenyl)methyl]thiourea

Systemtic Name: 1-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-3-[(4-fluorophenyl)methyl]thiourea Openeye Name: 1-[(4-fluorophenyl)methyl]-3-[(4S)-thiochroman-4-yl]thiourea CAS Name: 1-[(4S)-3,4-dihydro-2H-1-benzothiopyran-4-yl]-3-[(4-fluorophenyl)methyl]thiourea IUPAC Name: 1-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-3-[(4-fluorophenyl)methyl]thiourea Traditional Name: 1-(4-fluorobenzyl)-3-[(4S)-thiochroman-4-yl]thiourea Formula: C17H17FN2S2 MolecularWeight: 332.458683

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=CC=CC=C2C1NC(=S)NCC3=CC=C(C=C3)F

Isomeric SMILES

C1CSC2=CC=CC=C2[C@H]1NC(=S)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C17H17FN2S2/c18-13-7-5-12(6-8-13)11-19-17(21)20-15-9-10-22-16-4-2-1-3-14(15)16/h1-8,15H,9-11H2,(H2,19,20,21)/t15-/m0/s1