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

Systemtic Name: 1-[(4S)-6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl]-3-(3-methylphenyl)thiourea Openeye Name: 1-[(4S)-6-fluorothiochroman-4-yl]-3-(m-tolyl)thiourea CAS Name: 1-[(4S)-6-fluoro-3,4-dihydro-2H-1-benzothiopyran-4-yl]-3-(3-methylphenyl)thiourea IUPAC Name: 1-[(4S)-6-fluoro-3,4-dihydro-2H-thiochromen-4-yl]-3-(3-methylphenyl)thiourea Traditional Name: 1-[(4S)-6-fluorothiochroman-4-yl]-3-(m-tolyl)thiourea Formula: C17H17FN2S2 MolecularWeight: 332.458683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)NC2CCSC3=C2C=C(C=C3)F

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)N[C@H]2CCSC3=C2C=C(C=C3)F

InChI

InChI=1S/C17H17FN2S2/c1-11-3-2-4-13(9-11)19-17(21)20-15-7-8-22-16-6-5-12(18)10-14(15)16/h2-6,9-10,15H,7-8H2,1H3,(H2,19,20,21)/t15-/m0/s1