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

Systemtic Name: 1-[(3-bromophenyl)methyl]-3-(4-ethoxyphenyl)-1-(oxolan-2-ylmethyl)thiourea Openeye Name: 1-[(3-bromophenyl)methyl]-3-(4-ethoxyphenyl)-1-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 1-[(3-bromophenyl)methyl]-3-(4-ethoxyphenyl)-1-(2-oxolanylmethyl)thiourea IUPAC Name: 1-[(3-bromophenyl)methyl]-3-(4-ethoxyphenyl)-1-(oxolan-2-ylmethyl)thiourea Traditional Name: 1-(3-bromobenzyl)-3-p-phenetyl-1-(tetrahydrofurfuryl)thiourea Formula: C21H25BrN2O2S MolecularWeight: 449.4044

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)N(CC2CCCO2)CC3=CC(=CC=C3)Br

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)N(CC2CCCO2)CC3=CC(=CC=C3)Br

InChI

InChI=1S/C21H25BrN2O2S/c1-2-25-19-10-8-18(9-11-19)23-21(27)24(15-20-7-4-12-26-20)14-16-5-3-6-17(22)13-16/h3,5-6,8-11,13,20H,2,4,7,12,14-15H2,1H3,(H,23,27)