1-tert-butyl-3-(1-oxidanyl-3-pyridin-4-yl-propan-2-yl)thiourea

Systemtic Name: 1-tert-butyl-3-(1-oxidanyl-3-pyridin-4-yl-propan-2-yl)thiourea Openeye Name: 1-tert-butyl-3-[1-(hydroxymethyl)-2-(4-pyridyl)ethyl]thiourea CAS Name: 1-tert-butyl-3-(1-hydroxy-3-pyridin-4-ylpropan-2-yl)thiourea IUPAC Name: 1-tert-butyl-3-(1-hydroxy-3-pyridin-4-ylpropan-2-yl)thiourea Traditional Name: 1-tert-butyl-3-[1-methylol-2-(4-pyridyl)ethyl]thiourea Formula: C13H21N3OS MolecularWeight: 267.39034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)NC(CC1=CC=NC=C1)CO

Isomeric SMILES

CC(C)(C)NC(=S)NC(CC1=CC=NC=C1)CO

InChI

InChI=1S/C13H21N3OS/c1-13(2,3)16-12(18)15-11(9-17)8-10-4-6-14-7-5-10/h4-7,11,17H,8-9H2,1-3H3,(H2,15,16,18)