1-(3,3-dimethyl-1-oxidanyl-butan-2-yl)-3-pyridin-3-yl-thiourea

Systemtic Name: 1-(3,3-dimethyl-1-oxidanyl-butan-2-yl)-3-pyridin-3-yl-thiourea Openeye Name: 1-[1-(hydroxymethyl)-2,2-dimethyl-propyl]-3-(3-pyridyl)thiourea CAS Name: 1-(1-hydroxy-3,3-dimethylbutan-2-yl)-3-(3-pyridinyl)thiourea IUPAC Name: 1-(1-hydroxy-3,3-dimethylbutan-2-yl)-3-pyridin-3-ylthiourea Traditional Name: 1-(2,2-dimethyl-1-methylol-propyl)-3-(3-pyridyl)thiourea Formula: C12H19N3OS MolecularWeight: 253.36376

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(CO)NC(=S)NC1=CN=CC=C1

Isomeric SMILES

CC(C)(C)C(CO)NC(=S)NC1=CN=CC=C1

InChI

InChI=1S/C12H19N3OS/c1-12(2,3)10(8-16)15-11(17)14-9-5-4-6-13-7-9/h4-7,10,16H,8H2,1-3H3,(H2,14,15,17)