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

Systemtic Name: 3-(4-bromophenyl)-1-[(4-tert-butylphenyl)methyl]-1-(oxolan-2-ylmethyl)thiourea Openeye Name: 3-(4-bromophenyl)-1-[(4-tert-butylphenyl)methyl]-1-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 3-(4-bromophenyl)-1-[(4-tert-butylphenyl)methyl]-1-(2-oxolanylmethyl)thiourea IUPAC Name: 3-(4-bromophenyl)-1-[(4-tert-butylphenyl)methyl]-1-(oxolan-2-ylmethyl)thiourea Traditional Name: 3-(4-bromophenyl)-1-(4-tert-butylbenzyl)-1-(tetrahydrofurfuryl)thiourea Formula: C23H29BrN2OS MolecularWeight: 461.45816

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29BrN2OS/c1-23(2,3)18-8-6-17(7-9-18)15-26(16-21-5-4-14-27-21)22(28)25-20-12-10-19(24)11-13-20/h6-13,21H,4-5,14-16H2,1-3H3,(H,25,28)