5-[(4-methylphenyl)methylamino]-2-[4-[(3S)-3-methylpiperidin-1-yl]sulfonylphenyl]-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-[(4-methylphenyl)methylamino]-2-[4-[(3S)-3-methylpiperidin-1-yl]sulfonylphenyl]-1,3-oxazole-4-carbonitrile Openeye Name: 2-[4-[[(3S)-3-methyl-1-piperidyl]sulfonyl]phenyl]-5-(p-tolylmethylamino)oxazole-4-carbonitrile CAS Name: 5-[(4-methylphenyl)methylamino]-2-[4-[[(3S)-3-methyl-1-piperidinyl]sulfonyl]phenyl]-4-oxazolecarbonitrile IUPAC Name: 5-[(4-methylphenyl)methylamino]-2-[4-[(3S)-3-methylpiperidin-1-yl]sulfonylphenyl]-1,3-oxazole-4-carbonitrile Traditional Name: 5-[(4-methylbenzyl)amino]-2-[4-[(3S)-3-methylpiperidino]sulfonylphenyl]oxazole-4-carbonitrile Formula: C24H26N4O3S MolecularWeight: 450.55324

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C3=NC(=C(O3)NCC4=CC=C(C=C4)C)C#N

Isomeric SMILES

C[C@H]1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C3=NC(=C(O3)NCC4=CC=C(C=C4)C)C#N

InChI

InChI=1S/C24H26N4O3S/c1-17-5-7-19(8-6-17)15-26-24-22(14-25)27-23(31-24)20-9-11-21(12-10-20)32(29,30)28-13-3-4-18(2)16-28/h5-12,18,26H,3-4,13,15-16H2,1-2H3/t18-/m0/s1