(E)-N-[(4-methylphenoxy)methyl]-3-(pyridin-3-ylmethylamino)oxy-1-thiophen-2-yl-prop-1-en-2-amine

Systemtic Name: (E)-N-[(4-methylphenoxy)methyl]-3-(pyridin-3-ylmethylamino)oxy-1-thiophen-2-yl-prop-1-en-2-amine Openeye Name: (E)-N-[(4-methylphenoxy)methyl]-3-(3-pyridylmethylamino)oxy-1-(2-thienyl)prop-1-en-2-amine CAS Name: (E)-N-[(4-methylphenoxy)methyl]-3-(3-pyridinylmethylamino)oxy-1-thiophen-2-yl-1-propen-2-amine IUPAC Name: (E)-N-[(4-methylphenoxy)methyl]-3-(pyridin-3-ylmethylamino)oxy-1-thiophen-2-ylprop-1-en-2-amine Traditional Name: (4-methylphenoxy)methyl-[(E)-1-[(3-pyridylmethylamino)oxymethyl]-2-(2-thienyl)vinyl]amine Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCNC(=CC2=CC=CS2)CONCC3=CN=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)OCN/C(=C/C2=CC=CS2)/CONCC3=CN=CC=C3

InChI

InChI=1S/C21H23N3O2S/c1-17-6-8-20(9-7-17)25-16-23-19(12-21-5-3-11-27-21)15-26-24-14-18-4-2-10-22-13-18/h2-13,23-24H,14-16H2,1H3/b19-12+