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

Systemtic Name: 3-(4-bromophenyl)-1-[(4-ethylphenyl)methyl]-1-(oxolan-2-ylmethyl)thiourea Openeye Name: 3-(4-bromophenyl)-1-[(4-ethylphenyl)methyl]-1-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 3-(4-bromophenyl)-1-[(4-ethylphenyl)methyl]-1-(2-oxolanylmethyl)thiourea IUPAC Name: 3-(4-bromophenyl)-1-[(4-ethylphenyl)methyl]-1-(oxolan-2-ylmethyl)thiourea Traditional Name: 3-(4-bromophenyl)-1-(4-ethylbenzyl)-1-(tetrahydrofurfuryl)thiourea Formula: C21H25BrN2OS MolecularWeight: 433.405

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN(CC2CCCO2)C(=S)NC3=CC=C(C=C3)Br

Isomeric SMILES

CCC1=CC=C(C=C1)CN(CC2CCCO2)C(=S)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C21H25BrN2OS/c1-2-16-5-7-17(8-6-16)14-24(15-20-4-3-13-25-20)21(26)23-19-11-9-18(22)10-12-19/h5-12,20H,2-4,13-15H2,1H3,(H,23,26)