4-(4-phenethylpiperazin-1-yl)sulfonylbenzenecarbonitrile

Systemtic Name: 4-(4-phenethylpiperazin-1-yl)sulfonylbenzenecarbonitrile Openeye Name: 4-(4-phenethylpiperazin-1-yl)sulfonylbenzonitrile CAS Name: 4-[(4-phenethyl-1-piperazinyl)sulfonyl]benzonitrile IUPAC Name: 4-(4-phenethylpiperazin-1-yl)sulfonylbenzonitrile Traditional Name: 4-(4-phenethylpiperazino)sulfonylbenzonitrile Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1CN(CCN1CCC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H21N3O2S/c20-16-18-6-8-19(9-7-18)25(23,24)22-14-12-21(13-15-22)11-10-17-4-2-1-3-5-17/h1-9H,10-15H2