1-(6-fluoranyl-2,2-dimethyl-3,4-dihydrochromen-4-yl)-3-(3-methylphenyl)thiourea

Systemtic Name: 1-(6-fluoranyl-2,2-dimethyl-3,4-dihydrochromen-4-yl)-3-(3-methylphenyl)thiourea Openeye Name: 1-(6-fluoro-2,2-dimethyl-chroman-4-yl)-3-(m-tolyl)thiourea CAS Name: 1-(6-fluoro-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl)-3-(3-methylphenyl)thiourea IUPAC Name: 1-(6-fluoro-2,2-dimethyl-3,4-dihydrochromen-4-yl)-3-(3-methylphenyl)thiourea Traditional Name: 1-(6-fluoro-2,2-dimethyl-chroman-4-yl)-3-(m-tolyl)thiourea Formula: C19H21FN2OS MolecularWeight: 344.446243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)NC2CC(OC3=C2C=C(C=C3)F)(C)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)NC2CC(OC3=C2C=C(C=C3)F)(C)C

InChI

InChI=1S/C19H21FN2OS/c1-12-5-4-6-14(9-12)21-18(24)22-16-11-19(2,3)23-17-8-7-13(20)10-15(16)17/h4-10,16H,11H2,1-3H3,(H2,21,22,24)