1-(3-methylbutyl)-3-[2-(2,4,6-trimethylphenoxy)ethanoylamino]thiourea

Systemtic Name: 1-(3-methylbutyl)-3-[2-(2,4,6-trimethylphenoxy)ethanoylamino]thiourea Openeye Name: 1-isopentyl-3-[[2-(2,4,6-trimethylphenoxy)acetyl]amino]thiourea CAS Name: 1-(3-methylbutyl)-3-[[1-oxo-2-(2,4,6-trimethylphenoxy)ethyl]amino]thiourea IUPAC Name: 1-(3-methylbutyl)-3-[[2-(2,4,6-trimethylphenoxy)acetyl]amino]thiourea Traditional Name: 1-isoamyl-3-[[2-(2,4,6-trimethylphenoxy)acetyl]amino]thiourea Formula: C17H27N3O2S MolecularWeight: 337.48018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)OCC(=O)NNC(=S)NCCC(C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)OCC(=O)NNC(=S)NCCC(C)C)C

InChI

InChI=1S/C17H27N3O2S/c1-11(2)6-7-18-17(23)20-19-15(21)10-22-16-13(4)8-12(3)9-14(16)5/h8-9,11H,6-7,10H2,1-5H3,(H,19,21)(H2,18,20,23)