2-(4-quinazolin-4-ylpiperazin-1-yl)sulfonylbenzenecarbonitrile

Systemtic Name: 2-(4-quinazolin-4-ylpiperazin-1-yl)sulfonylbenzenecarbonitrile Openeye Name: 2-(4-quinazolin-4-ylpiperazin-1-yl)sulfonylbenzonitrile CAS Name: 2-[[4-(4-quinazolinyl)-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-(4-quinazolin-4-ylpiperazin-1-yl)sulfonylbenzonitrile Traditional Name: 2-(4-quinazolin-4-ylpiperazino)sulfonylbenzonitrile Formula: C19H17N5O2S MolecularWeight: 379.43558

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=NC3=CC=CC=C32)S(=O)(=O)C4=CC=CC=C4C#N

Isomeric SMILES

C1CN(CCN1C2=NC=NC3=CC=CC=C32)S(=O)(=O)C4=CC=CC=C4C#N

InChI

InChI=1S/C19H17N5O2S/c20-13-15-5-1-4-8-18(15)27(25,26)24-11-9-23(10-12-24)19-16-6-2-3-7-17(16)21-14-22-19/h1-8,14H,9-12H2