3-chloranyl-4-[2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethoxy]benzenecarbonitrile

Systemtic Name: 3-chloranyl-4-[2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethoxy]benzenecarbonitrile Openeye Name: 3-chloro-4-[2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethoxy]benzonitrile CAS Name: 3-chloro-4-[2-oxo-2-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]ethoxy]benzonitrile IUPAC Name: 3-chloro-4-[2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethoxy]benzonitrile Traditional Name: 3-chloro-4-[2-keto-2-[4-(2-thenoyl)piperazino]ethoxy]benzonitrile Formula: C18H16ClN3O3S MolecularWeight: 389.85594

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)COC2=C(C=C(C=C2)C#N)Cl)C(=O)C3=CC=CS3

Isomeric SMILES

C1CN(CCN1C(=O)COC2=C(C=C(C=C2)C#N)Cl)C(=O)C3=CC=CS3

InChI

InChI=1S/C18H16ClN3O3S/c19-14-10-13(11-20)3-4-15(14)25-12-17(23)21-5-7-22(8-6-21)18(24)16-2-1-9-26-16/h1-4,9-10H,5-8,12H2