3-(4-bromophenyl)-1-[(2,3-dimethoxyphenyl)methyl]-1-(oxolan-2-ylmethyl)thiourea

Systemtic Name: 3-(4-bromophenyl)-1-[(2,3-dimethoxyphenyl)methyl]-1-(oxolan-2-ylmethyl)thiourea Openeye Name: 3-(4-bromophenyl)-1-[(2,3-dimethoxyphenyl)methyl]-1-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 3-(4-bromophenyl)-1-[(2,3-dimethoxyphenyl)methyl]-1-(2-oxolanylmethyl)thiourea IUPAC Name: 3-(4-bromophenyl)-1-[(2,3-dimethoxyphenyl)methyl]-1-(oxolan-2-ylmethyl)thiourea Traditional Name: 3-(4-bromophenyl)-1-o-veratryl-1-(tetrahydrofurfuryl)thiourea Formula: C21H25BrN2O3S MolecularWeight: 465.4038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)CN(CC2CCCO2)C(=S)NC3=CC=C(C=C3)Br

Isomeric SMILES

COC1=CC=CC(=C1OC)CN(CC2CCCO2)C(=S)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C21H25BrN2O3S/c1-25-19-7-3-5-15(20(19)26-2)13-24(14-18-6-4-12-27-18)21(28)23-17-10-8-16(22)9-11-17/h3,5,7-11,18H,4,6,12-14H2,1-2H3,(H,23,28)