1-(6-bromanyl-2,2-dimethyl-3,4-dihydrochromen-4-yl)-3-[3-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-(6-bromanyl-2,2-dimethyl-3,4-dihydrochromen-4-yl)-3-[3-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-(6-bromo-2,2-dimethyl-chroman-4-yl)-3-[3-(trifluoromethyl)phenyl]thiourea CAS Name: 1-(6-bromo-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl)-3-[3-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-(6-bromo-2,2-dimethyl-3,4-dihydrochromen-4-yl)-3-[3-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-(6-bromo-2,2-dimethyl-chroman-4-yl)-3-[3-(trifluoromethyl)phenyl]thiourea Formula: C19H18BrF3N2OS MolecularWeight: 459.32323

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C2=C(O1)C=CC(=C2)Br)NC(=S)NC3=CC=CC(=C3)C(F)(F)F)C

Isomeric SMILES

CC1(CC(C2=C(O1)C=CC(=C2)Br)NC(=S)NC3=CC=CC(=C3)C(F)(F)F)C

InChI

InChI=1S/C19H18BrF3N2OS/c1-18(2)10-15(14-9-12(20)6-7-16(14)26-18)25-17(27)24-13-5-3-4-11(8-13)19(21,22)23/h3-9,15H,10H2,1-2H3,(H2,24,25,27)