1-[[5-methyl-2-(2-methyl-2-oxidanyl-propyl)hexanoyl]amino]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[[5-methyl-2-(2-methyl-2-oxidanyl-propyl)hexanoyl]amino]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[[2-(2-hydroxy-2-methyl-propyl)-5-methyl-hexanoyl]amino]thiourea CAS Name: 1-[[2-(2-hydroxy-2-methylpropyl)-5-methyl-1-oxohexyl]amino]-3-prop-2-enylthiourea IUPAC Name: 1-[[2-(2-hydroxy-2-methylpropyl)-5-methylhexanoyl]amino]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[[2-(2-hydroxy-2-methyl-propyl)-5-methyl-hexanoyl]amino]thiourea Formula: C15H29N3O2S MolecularWeight: 315.47466

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(CC(C)(C)O)C(=O)NNC(=S)NCC=C

Isomeric SMILES

CC(C)CCC(CC(C)(C)O)C(=O)NNC(=S)NCC=C

InChI

InChI=1S/C15H29N3O2S/c1-6-9-16-14(21)18-17-13(19)12(8-7-11(2)3)10-15(4,5)20/h6,11-12,20H,1,7-10H2,2-5H3,(H,17,19)(H2,16,18,21)