3-[[3-[[4-(1,3-thiazol-2-yl)pyrimidin-2-yl]amino]phenoxy]methyl]benzenecarbonitrile

Systemtic Name: 3-[[3-[[4-(1,3-thiazol-2-yl)pyrimidin-2-yl]amino]phenoxy]methyl]benzenecarbonitrile Openeye Name: 3-[[3-[(4-thiazol-2-ylpyrimidin-2-yl)amino]phenoxy]methyl]benzonitrile CAS Name: 3-[[3-[[4-(2-thiazolyl)-2-pyrimidinyl]amino]phenoxy]methyl]benzonitrile IUPAC Name: 3-[[3-[[4-(1,3-thiazol-2-yl)pyrimidin-2-yl]amino]phenoxy]methyl]benzonitrile Traditional Name: 3-[[3-[(4-thiazol-2-ylpyrimidin-2-yl)amino]phenoxy]methyl]benzonitrile Formula: C21H15N5OS MolecularWeight: 385.4417

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)COC2=CC=CC(=C2)NC3=NC=CC(=N3)C4=NC=CS4)C#N

Isomeric SMILES

C1=CC(=CC(=C1)COC2=CC=CC(=C2)NC3=NC=CC(=N3)C4=NC=CS4)C#N

InChI

InChI=1S/C21H15N5OS/c22-13-15-3-1-4-16(11-15)14-27-18-6-2-5-17(12-18)25-21-24-8-7-19(26-21)20-23-9-10-28-20/h1-12H,14H2,(H,24,25,26)