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

Systemtic Name: 2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-(3,5-dimethylisoxazol-4-yl)sulfonylpiperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-(3,5-dimethylisoxazol-4-yl)sulfonylpiperazino]sulfonylbenzonitrile Formula: C16H18N4O5S2 MolecularWeight: 410.46792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N

InChI

InChI=1S/C16H18N4O5S2/c1-12-16(13(2)25-18-12)27(23,24)20-9-7-19(8-10-20)26(21,22)15-6-4-3-5-14(15)11-17/h3-6H,7-10H2,1-2H3