1-(2-adamantyl)-3-(5-bromanylpyridin-2-yl)thiourea

Systemtic Name: 1-(2-adamantyl)-3-(5-bromanylpyridin-2-yl)thiourea Openeye Name: 1-(2-adamantyl)-3-(5-bromo-2-pyridyl)thiourea CAS Name: 1-(2-adamantyl)-3-(5-bromo-2-pyridinyl)thiourea IUPAC Name: 1-(2-adamantyl)-3-(5-bromopyridin-2-yl)thiourea Traditional Name: 1-(2-adamantyl)-3-(5-bromo-2-pyridyl)thiourea Formula: C16H20BrN3S MolecularWeight: 366.3191

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3NC(=S)NC4=NC=C(C=C4)Br

Isomeric SMILES

C1C2CC3CC1CC(C2)C3NC(=S)NC4=NC=C(C=C4)Br

InChI

InChI=1S/C16H20BrN3S/c17-13-1-2-14(18-8-13)19-16(21)20-15-11-4-9-3-10(6-11)7-12(15)5-9/h1-2,8-12,15H,3-7H2,(H2,18,19,20,21)