4-[4-[2-(2-oxidanylidene-1,3-benzoxazol-3-yl)ethanoyl]piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 4-[4-[2-(2-oxidanylidene-1,3-benzoxazol-3-yl)ethanoyl]piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 4-[4-[2-(2-oxo-1,3-benzoxazol-3-yl)acetyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 4-[[4-[1-oxo-2-(2-oxo-1,3-benzoxazol-3-yl)ethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 4-[4-[2-(2-oxo-1,3-benzoxazol-3-yl)acetyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 4-[4-[2-(2-keto-1,3-benzoxazol-3-yl)acetyl]piperazino]sulfonylbenzonitrile Formula: C20H18N4O5S MolecularWeight: 426.44572

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CN2C3=CC=CC=C3OC2=O)S(=O)(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1CN(CCN1C(=O)CN2C3=CC=CC=C3OC2=O)S(=O)(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C20H18N4O5S/c21-13-15-5-7-16(8-6-15)30(27,28)23-11-9-22(10-12-23)19(25)14-24-17-3-1-2-4-18(17)29-20(24)26/h1-8H,9-12,14H2