1,3-bis(5,5-dimethyl-7-oxidanyl-heptyl)thiourea

Systemtic Name: 1,3-bis(5,5-dimethyl-7-oxidanyl-heptyl)thiourea Openeye Name: 1,3-bis(7-hydroxy-5,5-dimethyl-heptyl)thiourea CAS Name: 1,3-bis(7-hydroxy-5,5-dimethylheptyl)thiourea IUPAC Name: 1,3-bis(7-hydroxy-5,5-dimethylheptyl)thiourea Traditional Name: 1,3-bis(7-hydroxy-5,5-dimethyl-heptyl)thiourea Formula: C19H40N2O2S MolecularWeight: 360.5981

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCCNC(=S)NCCCCC(C)(C)CCO)CCO

Isomeric SMILES

CC(C)(CCCCNC(=S)NCCCCC(C)(C)CCO)CCO

InChI

InChI=1S/C19H40N2O2S/c1-18(2,11-15-22)9-5-7-13-20-17(24)21-14-8-6-10-19(3,4)12-16-23/h22-23H,5-16H2,1-4H3,(H2,20,21,24)