2-(3-piperidin-1-ylquinoxalin-2-yl)-2-thiophen-2-ylsulfonyl-ethanenitrile

Systemtic Name: 2-(3-piperidin-1-ylquinoxalin-2-yl)-2-thiophen-2-ylsulfonyl-ethanenitrile Openeye Name: 2-[3-(1-piperidyl)quinoxalin-2-yl]-2-(2-thienylsulfonyl)acetonitrile CAS Name: 2-[3-(1-piperidinyl)-2-quinoxalinyl]-2-thiophen-2-ylsulfonylacetonitrile IUPAC Name: 2-(3-piperidin-1-ylquinoxalin-2-yl)-2-thiophen-2-ylsulfonylacetonitrile Traditional Name: 2-(3-piperidinoquinoxalin-2-yl)-2-(2-thienylsulfonyl)acetonitrile Formula: C19H18N4O2S2 MolecularWeight: 398.50182

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC3=CC=CC=C3N=C2C(C#N)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CCN(CC1)C2=NC3=CC=CC=C3N=C2C(C#N)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C19H18N4O2S2/c20-13-16(27(24,25)17-9-6-12-26-17)18-19(23-10-4-1-5-11-23)22-15-8-3-2-7-14(15)21-18/h2-3,6-9,12,16H,1,4-5,10-11H2