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

Systemtic Name: 3-(4-bromophenyl)-1-[(4-dimethylaminophenyl)methyl]-1-(oxolan-2-ylmethyl)thiourea Openeye Name: 3-(4-bromophenyl)-1-[(4-dimethylaminophenyl)methyl]-1-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 3-(4-bromophenyl)-1-[(4-dimethylaminophenyl)methyl]-1-(2-oxolanylmethyl)thiourea IUPAC Name: 3-(4-bromophenyl)-1-[(4-dimethylaminophenyl)methyl]-1-(oxolan-2-ylmethyl)thiourea Traditional Name: 3-(4-bromophenyl)-1-[4-(dimethylamino)benzyl]-1-(tetrahydrofurfuryl)thiourea Formula: C21H26BrN3OS MolecularWeight: 448.41964

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CN(CC2CCCO2)C(=S)NC3=CC=C(C=C3)Br

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CN(CC2CCCO2)C(=S)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C21H26BrN3OS/c1-24(2)19-11-5-16(6-12-19)14-25(15-20-4-3-13-26-20)21(27)23-18-9-7-17(22)8-10-18/h5-12,20H,3-4,13-15H2,1-2H3,(H,23,27)