4-[4-(3-phenylimidazol-4-yl)carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 4-[4-(3-phenylimidazol-4-yl)carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 4-[4-(3-phenylimidazole-4-carbonyl)piperazin-1-yl]sulfonylbenzonitrile CAS Name: 4-[[4-[oxo-(3-phenyl-4-imidazolyl)methyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 4-[4-(3-phenylimidazole-4-carbonyl)piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 4-[4-(3-phenylimidazole-4-carbonyl)piperazino]sulfonylbenzonitrile Formula: C21H19N5O3S MolecularWeight: 421.47226

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CN=CN2C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1CN(CCN1C(=O)C2=CN=CN2C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C21H19N5O3S/c22-14-17-6-8-19(9-7-17)30(28,29)25-12-10-24(11-13-25)21(27)20-15-23-16-26(20)18-4-2-1-3-5-18/h1-9,15-16H,10-13H2