3-(4-bromophenyl)-1-[(2-methylphenyl)methyl]-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 3-(4-bromophenyl)-1-[(2-methylphenyl)methyl]-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 3-(4-bromophenyl)-1-(o-tolylmethyl)-1-(3-pyridylmethyl)thiourea CAS Name: 3-(4-bromophenyl)-1-[(2-methylphenyl)methyl]-1-(3-pyridinylmethyl)thiourea IUPAC Name: 3-(4-bromophenyl)-1-[(2-methylphenyl)methyl]-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 3-(4-bromophenyl)-1-(2-methylbenzyl)-1-(3-pyridylmethyl)thiourea Formula: C21H20BrN3S MolecularWeight: 426.3726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN(CC2=CN=CC=C2)C(=S)NC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC=CC=C1CN(CC2=CN=CC=C2)C(=S)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C21H20BrN3S/c1-16-5-2-3-7-18(16)15-25(14-17-6-4-12-23-13-17)21(26)24-20-10-8-19(22)9-11-20/h2-13H,14-15H2,1H3,(H,24,26)