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

Systemtic Name: 2-[4-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethanoyl]piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-[2-(3,5-dimethylisoxazol-4-yl)acetyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[2-(3,5-dimethyl-4-isoxazolyl)-1-oxoethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-[2-(3,5-dimethylisoxazol-4-yl)acetyl]piperazino]sulfonylbenzonitrile Formula: C18H20N4O4S MolecularWeight: 388.4408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N4O4S/c1-13-16(14(2)26-20-13)11-18(23)21-7-9-22(10-8-21)27(24,25)17-6-4-3-5-15(17)12-19/h3-6H,7-11H2,1-2H3