3-[3-[methyl(thiophen-3-ylmethyl)amino]-2-oxidanyl-propoxy]benzenecarbonitrile

Systemtic Name: 3-[3-[methyl(thiophen-3-ylmethyl)amino]-2-oxidanyl-propoxy]benzenecarbonitrile Openeye Name: 3-[2-hydroxy-3-[methyl(3-thienylmethyl)amino]propoxy]benzonitrile CAS Name: 3-[2-hydroxy-3-[methyl(3-thiophenylmethyl)amino]propoxy]benzonitrile IUPAC Name: 3-[2-hydroxy-3-[methyl(thiophen-3-ylmethyl)amino]propoxy]benzonitrile Traditional Name: 3-[2-hydroxy-3-[methyl(3-thenyl)amino]propoxy]benzonitrile Formula: C16H18N2O2S MolecularWeight: 302.39132

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CSC=C1)CC(COC2=CC=CC(=C2)C#N)O

Isomeric SMILES

CN(CC1=CSC=C1)CC(COC2=CC=CC(=C2)C#N)O

InChI

InChI=1S/C16H18N2O2S/c1-18(9-14-5-6-21-12-14)10-15(19)11-20-16-4-2-3-13(7-16)8-17/h2-7,12,15,19H,9-11H2,1H3