3-[3-[methyl(3-methylbutan-2-yl)amino]-2-oxidanyl-propoxy]benzenecarbothioamide

Systemtic Name: 3-[3-[methyl(3-methylbutan-2-yl)amino]-2-oxidanyl-propoxy]benzenecarbothioamide Openeye Name: 3-[3-[1,2-dimethylpropyl(methyl)amino]-2-hydroxy-propoxy]benzenecarbothioamide CAS Name: 3-[2-hydroxy-3-[methyl(3-methylbutan-2-yl)amino]propoxy]benzenecarbothioamide IUPAC Name: 3-[2-hydroxy-3-[methyl(3-methylbutan-2-yl)amino]propoxy]benzenecarbothioamide Traditional Name: 3-[3-[1,2-dimethylpropyl(methyl)amino]-2-hydroxy-propoxy]thiobenzamide Formula: C16H26N2O2S MolecularWeight: 310.45484

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)N(C)CC(COC1=CC=CC(=C1)C(=S)N)O

Isomeric SMILES

CC(C)C(C)N(C)CC(COC1=CC=CC(=C1)C(=S)N)O

InChI

InChI=1S/C16H26N2O2S/c1-11(2)12(3)18(4)9-14(19)10-20-15-7-5-6-13(8-15)16(17)21/h5-8,11-12,14,19H,9-10H2,1-4H3,(H2,17,21)