2-(1,3-benzoxazol-2-ylamino)-4-phenyl-pyrimidine-5-carbonitrile

Systemtic Name: 2-(1,3-benzoxazol-2-ylamino)-4-phenyl-pyrimidine-5-carbonitrile Openeye Name: 2-(1,3-benzoxazol-2-ylamino)-4-phenyl-pyrimidine-5-carbonitrile CAS Name: 2-(1,3-benzoxazol-2-ylamino)-4-phenyl-5-pyrimidinecarbonitrile IUPAC Name: 2-(1,3-benzoxazol-2-ylamino)-4-phenylpyrimidine-5-carbonitrile Traditional Name: 2-(1,3-benzoxazol-2-ylamino)-4-phenyl-pyrimidine-5-carbonitrile Formula: C18H11N5O MolecularWeight: 313.31284

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NC=C2C#N)NC3=NC4=CC=CC=C4O3

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NC=C2C#N)NC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C18H11N5O/c19-10-13-11-20-17(22-16(13)12-6-2-1-3-7-12)23-18-21-14-8-4-5-9-15(14)24-18/h1-9,11H,(H,20,21,22,23)