2-[[3-(morpholin-4-ylmethyl)phenyl]amino]-4-phenyl-pyrimidine-5-carbonitrile

Systemtic Name: 2-[[3-(morpholin-4-ylmethyl)phenyl]amino]-4-phenyl-pyrimidine-5-carbonitrile Openeye Name: 2-[3-(morpholinomethyl)anilino]-4-phenyl-pyrimidine-5-carbonitrile CAS Name: 2-[3-(4-morpholinylmethyl)anilino]-4-phenyl-5-pyrimidinecarbonitrile IUPAC Name: 2-[3-(morpholin-4-ylmethyl)anilino]-4-phenylpyrimidine-5-carbonitrile Traditional Name: 2-[3-(morpholinomethyl)anilino]-4-phenyl-pyrimidine-5-carbonitrile Formula: C22H21N5O MolecularWeight: 371.43504

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC2=CC(=CC=C2)NC3=NC=C(C(=N3)C4=CC=CC=C4)C#N

Isomeric SMILES

C1COCCN1CC2=CC(=CC=C2)NC3=NC=C(C(=N3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C22H21N5O/c23-14-19-15-24-22(26-21(19)18-6-2-1-3-7-18)25-20-8-4-5-17(13-20)16-27-9-11-28-12-10-27/h1-8,13,15H,9-12,16H2,(H,24,25,26)