3-(4-bromophenyl)-1-[(2-ethoxyphenyl)methyl]-1-(furan-2-ylmethyl)thiourea

Systemtic Name: 3-(4-bromophenyl)-1-[(2-ethoxyphenyl)methyl]-1-(furan-2-ylmethyl)thiourea Openeye Name: 3-(4-bromophenyl)-1-[(2-ethoxyphenyl)methyl]-1-(2-furylmethyl)thiourea CAS Name: 3-(4-bromophenyl)-1-[(2-ethoxyphenyl)methyl]-1-(2-furanylmethyl)thiourea IUPAC Name: 3-(4-bromophenyl)-1-[(2-ethoxyphenyl)methyl]-1-(furan-2-ylmethyl)thiourea Traditional Name: 3-(4-bromophenyl)-1-(2-ethoxybenzyl)-1-(2-furfuryl)thiourea Formula: C21H21BrN2O2S MolecularWeight: 445.37264

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1CN(CC2=CC=CO2)C(=S)NC3=CC=C(C=C3)Br

Isomeric SMILES

CCOC1=CC=CC=C1CN(CC2=CC=CO2)C(=S)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C21H21BrN2O2S/c1-2-25-20-8-4-3-6-16(20)14-24(15-19-7-5-13-26-19)21(27)23-18-11-9-17(22)10-12-18/h3-13H,2,14-15H2,1H3,(H,23,27)