2-[[2-methyl-3-[[2-oxidanylidene-4-(2-thiophen-2-ylethoxy)pyridin-1-yl]methyl]phenyl]amino]ethanenitrile

Systemtic Name: 2-[[2-methyl-3-[[2-oxidanylidene-4-(2-thiophen-2-ylethoxy)pyridin-1-yl]methyl]phenyl]amino]ethanenitrile Openeye Name: 2-[2-methyl-3-[[2-oxo-4-[2-(2-thienyl)ethoxy]-1-pyridyl]methyl]anilino]acetonitrile CAS Name: 2-[2-methyl-3-[[2-oxo-4-(2-thiophen-2-ylethoxy)-1-pyridinyl]methyl]anilino]acetonitrile IUPAC Name: 2-[2-methyl-3-[[2-oxo-4-(2-thiophen-2-ylethoxy)pyridin-1-yl]methyl]anilino]acetonitrile Traditional Name: 2-[3-[[2-keto-4-[2-(2-thienyl)ethoxy]-1-pyridyl]methyl]-2-methyl-anilino]acetonitrile Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NCC#N)CN2C=CC(=CC2=O)OCCC3=CC=CS3

Isomeric SMILES

CC1=C(C=CC=C1NCC#N)CN2C=CC(=CC2=O)OCCC3=CC=CS3

InChI

InChI=1S/C21H21N3O2S/c1-16-17(4-2-6-20(16)23-10-9-22)15-24-11-7-18(14-21(24)25)26-12-8-19-5-3-13-27-19/h2-7,11,13-14,23H,8,10,12,15H2,1H3