2-[3-[(2-methyl-1-thiophen-2-yl-propan-2-yl)amino]-2-oxidanyl-propoxy]benzenecarbonitrile

Systemtic Name: 2-[3-[(2-methyl-1-thiophen-2-yl-propan-2-yl)amino]-2-oxidanyl-propoxy]benzenecarbonitrile Openeye Name: 2-[3-[[1,1-dimethyl-2-(2-thienyl)ethyl]amino]-2-hydroxy-propoxy]benzonitrile CAS Name: 2-[2-hydroxy-3-[(2-methyl-1-thiophen-2-ylpropan-2-yl)amino]propoxy]benzonitrile IUPAC Name: 2-[2-hydroxy-3-[(2-methyl-1-thiophen-2-ylpropan-2-yl)amino]propoxy]benzonitrile Traditional Name: 2-[3-[[1,1-dimethyl-2-(2-thienyl)ethyl]amino]-2-hydroxy-propoxy]benzonitrile Formula: C18H22N2O2S MolecularWeight: 330.44448

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC1=CC=CS1)NCC(COC2=CC=CC=C2C#N)O

Isomeric SMILES

CC(C)(CC1=CC=CS1)NCC(COC2=CC=CC=C2C#N)O

InChI

InChI=1S/C18H22N2O2S/c1-18(2,10-16-7-5-9-23-16)20-12-15(21)13-22-17-8-4-3-6-14(17)11-19/h3-9,15,20-21H,10,12-13H2,1-2H3