1-oxidanylidene-N-(2-piperidin-1-ylethyl)-8-thiophen-3-yl-2H-[1,2,4]triazolo[4,3-a]quinoline-5-carboxamide

Systemtic Name: 1-oxidanylidene-N-(2-piperidin-1-ylethyl)-8-thiophen-3-yl-2H-[1,2,4]triazolo[4,3-a]quinoline-5-carboxamide Openeye Name: 1-oxo-N-[2-(1-piperidyl)ethyl]-8-(3-thienyl)-2H-[1,2,4]triazolo[4,3-a]quinoline-5-carboxamide CAS Name: 1-oxo-N-[2-(1-piperidinyl)ethyl]-8-(3-thiophenyl)-2H-[1,2,4]triazolo[4,3-a]quinoline-5-carboxamide IUPAC Name: 1-oxo-N-(2-piperidin-1-ylethyl)-8-thiophen-3-yl-2H-[1,2,4]triazolo[4,3-a]quinoline-5-carboxamide Traditional Name: 1-keto-N-(2-piperidinoethyl)-8-(3-thienyl)-2H-[1,2,4]triazolo[4,3-a]quinoline-5-carboxamide Formula: C22H23N5O2S MolecularWeight: 421.51532

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCNC(=O)C2=CC3=NNC(=O)N3C4=C2C=CC(=C4)C5=CSC=C5

Isomeric SMILES

C1CCN(CC1)CCNC(=O)C2=CC3=NNC(=O)N3C4=C2C=CC(=C4)C5=CSC=C5

InChI

InChI=1S/C22H23N5O2S/c28-21(23-7-10-26-8-2-1-3-9-26)18-13-20-24-25-22(29)27(20)19-12-15(4-5-17(18)19)16-6-11-30-14-16/h4-6,11-14H,1-3,7-10H2,(H,23,28)(H,25,29)