4-[[4-(diethylamino)phenyl]amino]-2-methylsulfanyl-6-phenyl-pyrimidine-5-carbonitrile

Systemtic Name: 4-[[4-(diethylamino)phenyl]amino]-2-methylsulfanyl-6-phenyl-pyrimidine-5-carbonitrile Openeye Name: 4-[4-(diethylamino)anilino]-2-methylsulfanyl-6-phenyl-pyrimidine-5-carbonitrile CAS Name: 4-[4-(diethylamino)anilino]-2-(methylthio)-6-phenyl-5-pyrimidinecarbonitrile IUPAC Name: 4-[4-(diethylamino)anilino]-2-methylsulfanyl-6-phenylpyrimidine-5-carbonitrile Traditional Name: 4-[4-(diethylamino)anilino]-2-(methylthio)-6-phenyl-pyrimidine-5-carbonitrile Formula: C22H23N5S MolecularWeight: 389.51652

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)NC2=NC(=NC(=C2C#N)C3=CC=CC=C3)SC

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)NC2=NC(=NC(=C2C#N)C3=CC=CC=C3)SC

InChI

InChI=1S/C22H23N5S/c1-4-27(5-2)18-13-11-17(12-14-18)24-21-19(15-23)20(25-22(26-21)28-3)16-9-7-6-8-10-16/h6-14H,4-5H2,1-3H3,(H,24,25,26)