1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-fluoranyl-4-methyl-phenyl)thiourea

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-fluoranyl-4-methyl-phenyl)thiourea Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-fluoro-4-methyl-phenyl)thiourea CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-fluoro-4-methylphenyl)thiourea IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-fluoro-4-methylphenyl)thiourea Traditional Name: 1-(3-fluoro-4-methyl-phenyl)-3-homoveratryl-thiourea Formula: C18H21FN2O2S MolecularWeight: 348.434943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NCCC2=CC(=C(C=C2)OC)OC)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NCCC2=CC(=C(C=C2)OC)OC)F

InChI

InChI=1S/C18H21FN2O2S/c1-12-4-6-14(11-15(12)19)21-18(24)20-9-8-13-5-7-16(22-2)17(10-13)23-3/h4-7,10-11H,8-9H2,1-3H3,(H2,20,21,24)