2-[4-[(2-thiophen-3-yl-1,3-thiazol-4-yl)carbonyl]piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-[(2-thiophen-3-yl-1,3-thiazol-4-yl)carbonyl]piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-[2-(3-thienyl)thiazole-4-carbonyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[oxo-[2-(3-thiophenyl)-4-thiazolyl]methyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-(2-thiophen-3-yl-1,3-thiazole-4-carbonyl)piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-[2-(3-thienyl)thiazole-4-carbonyl]piperazino]sulfonylbenzonitrile Formula: C19H16N4O3S3 MolecularWeight: 444.55034

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CSC(=N2)C3=CSC=C3)S(=O)(=O)C4=CC=CC=C4C#N

Isomeric SMILES

C1CN(CCN1C(=O)C2=CSC(=N2)C3=CSC=C3)S(=O)(=O)C4=CC=CC=C4C#N

InChI

InChI=1S/C19H16N4O3S3/c20-11-14-3-1-2-4-17(14)29(25,26)23-8-6-22(7-9-23)19(24)16-13-28-18(21-16)15-5-10-27-12-15/h1-5,10,12-13H,6-9H2