5-morpholin-4-ylsulfonyl-2-(4-phenylpiperazin-1-yl)benzenecarbonitrile

Systemtic Name: 5-morpholin-4-ylsulfonyl-2-(4-phenylpiperazin-1-yl)benzenecarbonitrile Openeye Name: 5-morpholinosulfonyl-2-(4-phenylpiperazin-1-yl)benzonitrile CAS Name: 5-(4-morpholinylsulfonyl)-2-(4-phenyl-1-piperazinyl)benzonitrile IUPAC Name: 5-morpholin-4-ylsulfonyl-2-(4-phenylpiperazin-1-yl)benzonitrile Traditional Name: 5-morpholinosulfonyl-2-(4-phenylpiperazino)benzonitrile Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)C#N

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)C#N

InChI

InChI=1S/C21H24N4O3S/c22-17-18-16-20(29(26,27)25-12-14-28-15-13-25)6-7-21(18)24-10-8-23(9-11-24)19-4-2-1-3-5-19/h1-7,16H,8-15H2