1-[(E)-1-[(2R,4S)-4-butyl-2-methyl-5-oxidanylidene-oxolan-2-yl]ethylideneamino]thiourea

Systemtic Name: 1-[(E)-1-[(2R,4S)-4-butyl-2-methyl-5-oxidanylidene-oxolan-2-yl]ethylideneamino]thiourea Openeye Name: [(E)-1-[(2R,4S)-4-butyl-2-methyl-5-oxo-tetrahydrofuran-2-yl]ethylideneamino]thiourea CAS Name: [(E)-1-[(2R,4S)-4-butyl-2-methyl-5-oxo-2-oxolanyl]ethylideneamino]thiourea IUPAC Name: [(E)-1-[(2R,4S)-4-butyl-2-methyl-5-oxooxolan-2-yl]ethylideneamino]thiourea Traditional Name: [(E)-1-[(2R,4S)-4-butyl-5-keto-2-methyl-tetrahydrofuran-2-yl]ethylideneamino]thiourea Formula: C12H21N3O2S MolecularWeight: 271.37904

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CC(OC1=O)(C)C(=NNC(=S)N)C

Isomeric SMILES

CCCC[C@H]1C[C@](OC1=O)(C)/C(=N/NC(=S)N)/C

InChI

InChI=1S/C12H21N3O2S/c1-4-5-6-9-7-12(3,17-10(9)16)8(2)14-15-11(13)18/h9H,4-7H2,1-3H3,(H3,13,15,18)/b14-8+/t9-,12+/m0/s1