1-[4-[(3S,5R)-2-oxidanylidene-5-pentyl-oxolan-3-yl]but-1-en-2-ylamino]thiourea

Systemtic Name: 1-[4-[(3S,5R)-2-oxidanylidene-5-pentyl-oxolan-3-yl]but-1-en-2-ylamino]thiourea Openeye Name: [[1-methylene-3-[(3S,5R)-2-oxo-5-pentyl-tetrahydrofuran-3-yl]propyl]amino]thiourea CAS Name: [4-[(3S,5R)-2-oxo-5-pentyl-3-oxolanyl]but-1-en-2-ylamino]thiourea IUPAC Name: [4-[(3S,5R)-2-oxo-5-pentyloxolan-3-yl]but-1-en-2-ylamino]thiourea Traditional Name: [1-[2-[(3S,5R)-5-amyl-2-keto-tetrahydrofuran-3-yl]ethyl]vinylamino]thiourea Formula: C14H25N3O2S MolecularWeight: 299.4322

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CC(C(=O)O1)CCC(=C)NNC(=S)N

Isomeric SMILES

CCCCC[C@@H]1C[C@@H](C(=O)O1)CCC(=C)NNC(=S)N

InChI

InChI=1S/C14H25N3O2S/c1-3-4-5-6-12-9-11(13(18)19-12)8-7-10(2)16-17-14(15)20/h11-12,16H,2-9H2,1H3,(H3,15,17,20)/t11-,12+/m0/s1