2-[4-[2-(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)ethanoyl]piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-[2-(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)ethanoyl]piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-[2-[5-oxo-4-(2-thienyl)tetrazol-1-yl]acetyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[1-oxo-2-(5-oxo-4-thiophen-2-yl-1-tetrazolyl)ethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-[2-(5-oxo-4-thiophen-2-yltetrazol-1-yl)acetyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-[2-[5-keto-4-(2-thienyl)tetrazol-1-yl]acetyl]piperazino]sulfonylbenzonitrile Formula: C18H17N7O4S2 MolecularWeight: 459.50208

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CN2C(=O)N(N=N2)C3=CC=CS3)S(=O)(=O)C4=CC=CC=C4C#N

Isomeric SMILES

C1CN(CCN1C(=O)CN2C(=O)N(N=N2)C3=CC=CS3)S(=O)(=O)C4=CC=CC=C4C#N

InChI

InChI=1S/C18H17N7O4S2/c19-12-14-4-1-2-5-15(14)31(28,29)23-9-7-22(8-10-23)16(26)13-24-18(27)25(21-20-24)17-6-3-11-30-17/h1-6,11H,7-10,13H2