2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethyl carbamimidothioate

Systemtic Name: 2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethyl carbamimidothioate Openeye Name: 2-[2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]ethyl]isothiourea CAS Name: carbamimidothioic acid 2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethyl ester IUPAC Name: 2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethyl carbamimidothioate Traditional Name: 2-[2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]ethyl]isothiourea Formula: C17H28N2OS MolecularWeight: 308.48202

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OCCSC(=N)N

Isomeric SMILES

CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OCCSC(=N)N

InChI

InChI=1S/C17H28N2OS/c1-16(2,3)12-17(4,5)13-6-8-14(9-7-13)20-10-11-21-15(18)19/h6-9H,10-12H2,1-5H3,(H3,18,19)