2-[[(2S)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]methyl]quinazolin-4-amine

Systemtic Name: 2-[[(2S)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]methyl]quinazolin-4-amine Openeye Name: 2-[[(2S)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]methyl]quinazolin-4-amine CAS Name: 2-[[(2S)-2-thiophen-2-yl-1-pyrrolidin-1-iumyl]methyl]-4-quinazolinamine IUPAC Name: 2-[[(2S)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]methyl]quinazolin-4-amine Traditional Name: [2-[[(2S)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]methyl]quinazolin-4-yl]amine Formula: C17H19N4S+ MolecularWeight: 311.42456

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH+](C1)CC2=NC3=CC=CC=C3C(=N2)N)C4=CC=CS4

Isomeric SMILES

C1C[C@H]([NH+](C1)CC2=NC3=CC=CC=C3C(=N2)N)C4=CC=CS4

InChI

InChI=1S/C17H18N4S/c18-17-12-5-1-2-6-13(12)19-16(20-17)11-21-9-3-7-14(21)15-8-4-10-22-15/h1-2,4-6,8,10,14H,3,7,9,11H2,(H2,18,19,20)/p+1/t14-/m0/s1