1-[(E)-1-(5-methyl-2-oxidanylidene-3-propanoyl-oxolan-3-yl)propan-2-ylideneamino]thiourea

Systemtic Name: 1-[(E)-1-(5-methyl-2-oxidanylidene-3-propanoyl-oxolan-3-yl)propan-2-ylideneamino]thiourea Openeye Name: [(E)-[1-methyl-2-(5-methyl-2-oxo-3-propanoyl-tetrahydrofuran-3-yl)ethylidene]amino]thiourea CAS Name: [(E)-1-[5-methyl-2-oxo-3-(1-oxopropyl)-3-oxolanyl]propan-2-ylideneamino]thiourea IUPAC Name: [(E)-1-(5-methyl-2-oxo-3-propanoyloxolan-3-yl)propan-2-ylideneamino]thiourea Traditional Name: [(E)-[2-(2-keto-5-methyl-3-propionyl-tetrahydrofuran-3-yl)-1-methyl-ethylidene]amino]thiourea Formula: C12H19N3O3S MolecularWeight: 285.36256

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1(CC(OC1=O)C)CC(=NNC(=S)N)C

Isomeric SMILES

CCC(=O)C1(CC(OC1=O)C)C/C(=N/NC(=S)N)/C

InChI

InChI=1S/C12H19N3O3S/c1-4-9(16)12(6-8(3)18-10(12)17)5-7(2)14-15-11(13)19/h8H,4-6H2,1-3H3,(H3,13,15,19)/b14-7+