3-(4-bromophenyl)-1-(oxolan-2-ylmethyl)-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 3-(4-bromophenyl)-1-(oxolan-2-ylmethyl)-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 3-(4-bromophenyl)-1-(3-pyridylmethyl)-1-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 3-(4-bromophenyl)-1-(2-oxolanylmethyl)-1-(3-pyridinylmethyl)thiourea IUPAC Name: 3-(4-bromophenyl)-1-(oxolan-2-ylmethyl)-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 3-(4-bromophenyl)-1-(3-pyridylmethyl)-1-(tetrahydrofurfuryl)thiourea Formula: C18H20BrN3OS MolecularWeight: 406.3399

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN(CC2=CN=CC=C2)C(=S)NC3=CC=C(C=C3)Br

Isomeric SMILES

C1CC(OC1)CN(CC2=CN=CC=C2)C(=S)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C18H20BrN3OS/c19-15-5-7-16(8-6-15)21-18(24)22(13-17-4-2-10-23-17)12-14-3-1-9-20-11-14/h1,3,5-9,11,17H,2,4,10,12-13H2,(H,21,24)