1-pyridin-3-yl-3-(2,4,4-trimethylpentan-2-yl)thiourea

Systemtic Name: 1-pyridin-3-yl-3-(2,4,4-trimethylpentan-2-yl)thiourea Openeye Name: 1-(3-pyridyl)-3-(1,1,3,3-tetramethylbutyl)thiourea CAS Name: 1-(3-pyridinyl)-3-(2,4,4-trimethylpentan-2-yl)thiourea IUPAC Name: 1-pyridin-3-yl-3-(2,4,4-trimethylpentan-2-yl)thiourea Traditional Name: 1-(3-pyridyl)-3-(1,1,3,3-tetramethylbutyl)thiourea Formula: C14H23N3S MolecularWeight: 265.41752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H23N3S/c1-13(2,3)10-14(4,5)17-12(18)16-11-7-6-8-15-9-11/h6-9H,10H2,1-5H3,(H2,16,17,18)