2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonyl-benzenecarbonitrile

Systemtic Name: 2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonyl-benzenecarbonitrile Openeye Name: 2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonyl-benzonitrile CAS Name: 2-ethoxy-5-[(4-ethyl-1-piperazinyl)sulfonyl]benzonitrile IUPAC Name: 2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonylbenzonitrile Traditional Name: 2-ethoxy-5-(4-ethylpiperazino)sulfonyl-benzonitrile Formula: C15H21N3O3S MolecularWeight: 323.41054

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OCC)C#N

Isomeric SMILES

CCN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OCC)C#N

InChI

InChI=1S/C15H21N3O3S/c1-3-17-7-9-18(10-8-17)22(19,20)14-5-6-15(21-4-2)13(11-14)12-16/h5-6,11H,3-4,7-10H2,1-2H3