1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3-fluoranyl-4-methyl-phenyl)-1-(thiophen-2-ylmethyl)thiourea

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3-fluoranyl-4-methyl-phenyl)-1-(thiophen-2-ylmethyl)thiourea Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3-fluoro-4-methyl-phenyl)-1-(2-thienylmethyl)thiourea CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3-fluoro-4-methylphenyl)-1-(thiophen-2-ylmethyl)thiourea IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3-fluoro-4-methylphenyl)-1-(thiophen-2-ylmethyl)thiourea Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3-fluoro-4-methyl-phenyl)-1-(2-thenyl)thiourea Formula: C21H19FN2O2S2 MolecularWeight: 414.516163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)N(CC2=CC=CS2)C3=CC4=C(C=C3)OCCO4)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)N(CC2=CC=CS2)C3=CC4=C(C=C3)OCCO4)F

InChI

InChI=1S/C21H19FN2O2S2/c1-14-4-5-15(11-18(14)22)23-21(27)24(13-17-3-2-10-28-17)16-6-7-19-20(12-16)26-9-8-25-19/h2-7,10-12H,8-9,13H2,1H3,(H,23,27)