2-methyl-4-(4-methylsulfonylphenoxy)-6-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]pyrimidine-5-carbonitrile

Systemtic Name: 2-methyl-4-(4-methylsulfonylphenoxy)-6-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]pyrimidine-5-carbonitrile Openeye Name: 4-[4-(3-isopropyl-1,2,4-oxadiazol-5-yl)-1-piperidyl]-2-methyl-6-(4-methylsulfonylphenoxy)pyrimidine-5-carbonitrile CAS Name: 2-methyl-4-(4-methylsulfonylphenoxy)-6-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)-1-piperidinyl]-5-pyrimidinecarbonitrile IUPAC Name: 2-methyl-4-(4-methylsulfonylphenoxy)-6-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]pyrimidine-5-carbonitrile Traditional Name: 4-[4-(3-isopropyl-1,2,4-oxadiazol-5-yl)piperidino]-6-(4-mesylphenoxy)-2-methyl-pyrimidine-5-carbonitrile Formula: C23H26N6O4S MolecularWeight: 482.55534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=N1)OC2=CC=C(C=C2)S(=O)(=O)C)C#N)N3CCC(CC3)C4=NC(=NO4)C(C)C

Isomeric SMILES

CC1=NC(=C(C(=N1)OC2=CC=C(C=C2)S(=O)(=O)C)C#N)N3CCC(CC3)C4=NC(=NO4)C(C)C

InChI

InChI=1S/C23H26N6O4S/c1-14(2)20-27-22(33-28-20)16-9-11-29(12-10-16)21-19(13-24)23(26-15(3)25-21)32-17-5-7-18(8-6-17)34(4,30)31/h5-8,14,16H,9-12H2,1-4H3