4-morpholin-4-yl-6-phenyl-2-(phenylmethylsulfanyl)pyrimidine-5-carbonitrile

Systemtic Name: 4-morpholin-4-yl-6-phenyl-2-(phenylmethylsulfanyl)pyrimidine-5-carbonitrile Openeye Name: 2-benzylsulfanyl-4-morpholino-6-phenyl-pyrimidine-5-carbonitrile CAS Name: 4-(4-morpholinyl)-6-phenyl-2-(phenylmethylthio)-5-pyrimidinecarbonitrile IUPAC Name: 2-benzylsulfanyl-4-morpholin-4-yl-6-phenylpyrimidine-5-carbonitrile Traditional Name: 2-(benzylthio)-4-morpholino-6-phenyl-pyrimidine-5-carbonitrile Formula: C22H20N4OS MolecularWeight: 388.4854

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC(=NC(=C2C#N)C3=CC=CC=C3)SCC4=CC=CC=C4

Isomeric SMILES

C1COCCN1C2=NC(=NC(=C2C#N)C3=CC=CC=C3)SCC4=CC=CC=C4

InChI

InChI=1S/C22H20N4OS/c23-15-19-20(18-9-5-2-6-10-18)24-22(28-16-17-7-3-1-4-8-17)25-21(19)26-11-13-27-14-12-26/h1-10H,11-14,16H2