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

Systemtic Name: 1-(4-butylphenyl)-3-(2,4,4-trimethylpentan-2-yl)thiourea Openeye Name: 1-(4-butylphenyl)-3-(1,1,3,3-tetramethylbutyl)thiourea CAS Name: 1-(4-butylphenyl)-3-(2,4,4-trimethylpentan-2-yl)thiourea IUPAC Name: 1-(4-butylphenyl)-3-(2,4,4-trimethylpentan-2-yl)thiourea Traditional Name: 1-(4-butylphenyl)-3-(1,1,3,3-tetramethylbutyl)thiourea Formula: C19H32N2S MolecularWeight: 320.53578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NC(C)(C)CC(C)(C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NC(C)(C)CC(C)(C)C

InChI

InChI=1S/C19H32N2S/c1-7-8-9-15-10-12-16(13-11-15)20-17(22)21-19(5,6)14-18(2,3)4/h10-13H,7-9,14H2,1-6H3,(H2,20,21,22)