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

Systemtic Name: 3-(4-bromophenyl)-1-[(4-tert-butylphenyl)methyl]-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 3-(4-bromophenyl)-1-[(4-tert-butylphenyl)methyl]-1-(3-pyridylmethyl)thiourea CAS Name: 3-(4-bromophenyl)-1-[(4-tert-butylphenyl)methyl]-1-(3-pyridinylmethyl)thiourea IUPAC Name: 3-(4-bromophenyl)-1-[(4-tert-butylphenyl)methyl]-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 3-(4-bromophenyl)-1-(4-tert-butylbenzyl)-1-(3-pyridylmethyl)thiourea Formula: C24H26BrN3S MolecularWeight: 468.45234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN(CC2=CN=CC=C2)C(=S)NC3=CC=C(C=C3)Br

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN(CC2=CN=CC=C2)C(=S)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C24H26BrN3S/c1-24(2,3)20-8-6-18(7-9-20)16-28(17-19-5-4-14-26-15-19)23(29)27-22-12-10-21(25)11-13-22/h4-15H,16-17H2,1-3H3,(H,27,29)