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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)N(C)CC(COC1=CC=CC=C1C(=S)N)O

Isomeric SMILES

CCCC(C)N(C)CC(COC1=CC=CC=C1C(=S)N)O

InChI

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