4-[4-[(5-phenyl-1,3-oxazol-2-yl)methyl]piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 4-[4-[(5-phenyl-1,3-oxazol-2-yl)methyl]piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 4-[4-[(5-phenyloxazol-2-yl)methyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 4-[[4-[(5-phenyl-2-oxazolyl)methyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 4-[4-[(5-phenyl-1,3-oxazol-2-yl)methyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 4-[4-[(5-phenyloxazol-2-yl)methyl]piperazino]sulfonylbenzonitrile Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC=C(O2)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1CN(CCN1CC2=NC=C(O2)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C21H20N4O3S/c22-14-17-6-8-19(9-7-17)29(26,27)25-12-10-24(11-13-25)16-21-23-15-20(28-21)18-4-2-1-3-5-18/h1-9,15H,10-13,16H2