2-pentoxy-4-[(4-pyridin-3-yl-1,3-thiazol-2-yl)amino]benzenecarbonitrile

Systemtic Name: 2-pentoxy-4-[(4-pyridin-3-yl-1,3-thiazol-2-yl)amino]benzenecarbonitrile Openeye Name: 2-pentoxy-4-[[4-(3-pyridyl)thiazol-2-yl]amino]benzonitrile CAS Name: 2-pentoxy-4-[[4-(3-pyridinyl)-2-thiazolyl]amino]benzonitrile IUPAC Name: 2-pentoxy-4-[(4-pyridin-3-yl-1,3-thiazol-2-yl)amino]benzonitrile Traditional Name: 2-amoxy-4-[[4-(3-pyridyl)thiazol-2-yl]amino]benzonitrile Formula: C20H20N4OS MolecularWeight: 364.464

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=CC(=C1)NC2=NC(=CS2)C3=CN=CC=C3)C#N

Isomeric SMILES

CCCCCOC1=C(C=CC(=C1)NC2=NC(=CS2)C3=CN=CC=C3)C#N

InChI

InChI=1S/C20H20N4OS/c1-2-3-4-10-25-19-11-17(8-7-15(19)12-21)23-20-24-18(14-26-20)16-6-5-9-22-13-16/h5-9,11,13-14H,2-4,10H2,1H3,(H,23,24)