2-[4-[(2-thiophen-3-ylquinazolin-4-yl)amino]piperidin-1-ium-1-yl]ethanamide

Systemtic Name: 2-[4-[(2-thiophen-3-ylquinazolin-4-yl)amino]piperidin-1-ium-1-yl]ethanamide Openeye Name: 2-[4-[[2-(3-thienyl)quinazolin-4-yl]amino]piperidin-1-ium-1-yl]acetamide CAS Name: 2-[4-[[2-(3-thiophenyl)-4-quinazolinyl]amino]-1-piperidin-1-iumyl]acetamide IUPAC Name: 2-[4-[(2-thiophen-3-ylquinazolin-4-yl)amino]piperidin-1-ium-1-yl]acetamide Traditional Name: 2-[4-[[2-(3-thienyl)quinazolin-4-yl]amino]piperidin-1-ium-1-yl]acetamide Formula: C19H22N5OS+ MolecularWeight: 368.47588

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC2=NC(=NC3=CC=CC=C32)C4=CSC=C4)CC(=O)N

Isomeric SMILES

C1C[NH+](CCC1NC2=NC(=NC3=CC=CC=C32)C4=CSC=C4)CC(=O)N

InChI

InChI=1S/C19H21N5OS/c20-17(25)11-24-8-5-14(6-9-24)21-19-15-3-1-2-4-16(15)22-18(23-19)13-7-10-26-12-13/h1-4,7,10,12,14H,5-6,8-9,11H2,(H2,20,25)(H,21,22,23)/p+1