3-(3,4-dimethoxyphenyl)-1-[(4-fluorophenyl)methyl]-1-(furan-2-ylmethyl)thiourea

Systemtic Name: 3-(3,4-dimethoxyphenyl)-1-[(4-fluorophenyl)methyl]-1-(furan-2-ylmethyl)thiourea Openeye Name: 3-(3,4-dimethoxyphenyl)-1-[(4-fluorophenyl)methyl]-1-(2-furylmethyl)thiourea CAS Name: 3-(3,4-dimethoxyphenyl)-1-[(4-fluorophenyl)methyl]-1-(2-furanylmethyl)thiourea IUPAC Name: 3-(3,4-dimethoxyphenyl)-1-[(4-fluorophenyl)methyl]-1-(furan-2-ylmethyl)thiourea Traditional Name: 3-(3,4-dimethoxyphenyl)-1-(4-fluorobenzyl)-1-(2-furfuryl)thiourea Formula: C21H21FN2O3S MolecularWeight: 400.466443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=S)N(CC2=CC=C(C=C2)F)CC3=CC=CO3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=S)N(CC2=CC=C(C=C2)F)CC3=CC=CO3)OC

InChI

InChI=1S/C21H21FN2O3S/c1-25-19-10-9-17(12-20(19)26-2)23-21(28)24(14-18-4-3-11-27-18)13-15-5-7-16(22)8-6-15/h3-12H,13-14H2,1-2H3,(H,23,28)