2-[2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperazin-1-yl]carbonylphenyl]benzenecarbonitrile

Systemtic Name: 2-[2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperazin-1-yl]carbonylphenyl]benzenecarbonitrile Openeye Name: 2-[2-[4-(3,5-dimethylisoxazol-4-yl)sulfonylpiperazine-1-carbonyl]phenyl]benzonitrile CAS Name: 2-[2-[[4-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-1-piperazinyl]-oxomethyl]phenyl]benzonitrile IUPAC Name: 2-[2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperazine-1-carbonyl]phenyl]benzonitrile Traditional Name: 2-[2-[4-(3,5-dimethylisoxazol-4-yl)sulfonylpiperazine-1-carbonyl]phenyl]benzonitrile Formula: C23H22N4O4S MolecularWeight: 450.51018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CC=C3C4=CC=CC=C4C#N

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CC=C3C4=CC=CC=C4C#N

InChI

InChI=1S/C23H22N4O4S/c1-16-22(17(2)31-25-16)32(29,30)27-13-11-26(12-14-27)23(28)21-10-6-5-9-20(21)19-8-4-3-7-18(19)15-24/h3-10H,11-14H2,1-2H3