1-[2-(2-methyl-2-oxidanyl-propyl)hexanoylamino]-3-phenyl-thiourea

Systemtic Name: 1-[2-(2-methyl-2-oxidanyl-propyl)hexanoylamino]-3-phenyl-thiourea Openeye Name: 1-[2-(2-hydroxy-2-methyl-propyl)hexanoylamino]-3-phenyl-thiourea CAS Name: 1-[[2-(2-hydroxy-2-methylpropyl)-1-oxohexyl]amino]-3-phenylthiourea IUPAC Name: 1-[2-(2-hydroxy-2-methylpropyl)hexanoylamino]-3-phenylthiourea Traditional Name: 1-[2-(2-hydroxy-2-methyl-propyl)hexanoylamino]-3-phenyl-thiourea Formula: C17H27N3O2S MolecularWeight: 337.48018

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(C)(C)O)C(=O)NNC(=S)NC1=CC=CC=C1

Isomeric SMILES

CCCCC(CC(C)(C)O)C(=O)NNC(=S)NC1=CC=CC=C1

InChI

InChI=1S/C17H27N3O2S/c1-4-5-9-13(12-17(2,3)22)15(21)19-20-16(23)18-14-10-7-6-8-11-14/h6-8,10-11,13,22H,4-5,9,12H2,1-3H3,(H,19,21)(H2,18,20,23)