4-[4-(2-thiophen-2-ylquinazolin-4-yl)piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 4-[4-(2-thiophen-2-ylquinazolin-4-yl)piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 4-[4-[2-(2-thienyl)quinazolin-4-yl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 4-[[4-(2-thiophen-2-yl-4-quinazolinyl)-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 4-[4-(2-thiophen-2-ylquinazolin-4-yl)piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 4-[4-[2-(2-thienyl)quinazolin-4-yl]piperazino]sulfonylbenzonitrile Formula: C23H19N5O2S2 MolecularWeight: 461.55926

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC(=NC3=CC=CC=C32)C4=CC=CS4)S(=O)(=O)C5=CC=C(C=C5)C#N

Isomeric SMILES

C1CN(CCN1C2=NC(=NC3=CC=CC=C32)C4=CC=CS4)S(=O)(=O)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C23H19N5O2S2/c24-16-17-7-9-18(10-8-17)32(29,30)28-13-11-27(12-14-28)23-19-4-1-2-5-20(19)25-22(26-23)21-6-3-15-31-21/h1-10,15H,11-14H2