4-[[4-(2,4-dimethyl-1,3-thiazol-5-yl)pyrimidin-2-yl]amino]benzenecarbonitrile

Systemtic Name: 4-[[4-(2,4-dimethyl-1,3-thiazol-5-yl)pyrimidin-2-yl]amino]benzenecarbonitrile Openeye Name: 4-[[4-(2,4-dimethylthiazol-5-yl)pyrimidin-2-yl]amino]benzonitrile CAS Name: 4-[[4-(2,4-dimethyl-5-thiazolyl)-2-pyrimidinyl]amino]benzonitrile IUPAC Name: 4-[[4-(2,4-dimethyl-1,3-thiazol-5-yl)pyrimidin-2-yl]amino]benzonitrile Traditional Name: 4-[[4-(2,4-dimethylthiazol-5-yl)pyrimidin-2-yl]amino]benzonitrile Formula: C16H13N5S MolecularWeight: 307.37292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C)C2=NC(=NC=C2)NC3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=C(SC(=N1)C)C2=NC(=NC=C2)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C16H13N5S/c1-10-15(22-11(2)19-10)14-7-8-18-16(21-14)20-13-5-3-12(9-17)4-6-13/h3-8H,1-2H3,(H,18,20,21)