N-(4-methoxyphenyl)-4-[[2-(morpholin-4-ium-4-ylmethyl)quinazolin-4-yl]sulfanylmethyl]-1,3-thiazol-2-amine

Systemtic Name: N-(4-methoxyphenyl)-4-[[2-(morpholin-4-ium-4-ylmethyl)quinazolin-4-yl]sulfanylmethyl]-1,3-thiazol-2-amine Openeye Name: N-(4-methoxyphenyl)-4-[[2-(morpholin-4-ium-4-ylmethyl)quinazolin-4-yl]sulfanylmethyl]thiazol-2-amine CAS Name: N-(4-methoxyphenyl)-4-[[[2-(4-morpholin-4-iumylmethyl)-4-quinazolinyl]thio]methyl]-2-thiazolamine IUPAC Name: N-(4-methoxyphenyl)-4-[[2-(morpholin-4-ium-4-ylmethyl)quinazolin-4-yl]sulfanylmethyl]-1,3-thiazol-2-amine Traditional Name: (4-methoxyphenyl)-[4-[[[2-(morpholin-4-ium-4-ylmethyl)quinazolin-4-yl]thio]methyl]thiazol-2-yl]amine Formula: C24H26N5O2S2+ MolecularWeight: 480.62554

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=NC(=CS2)CSC3=NC(=NC4=CC=CC=C43)C[NH+]5CCOCC5

Isomeric SMILES

COC1=CC=C(C=C1)NC2=NC(=CS2)CSC3=NC(=NC4=CC=CC=C43)C[NH+]5CCOCC5

InChI

InChI=1S/C24H25N5O2S2/c1-30-19-8-6-17(7-9-19)25-24-26-18(16-33-24)15-32-23-20-4-2-3-5-21(20)27-22(28-23)14-29-10-12-31-13-11-29/h2-9,16H,10-15H2,1H3,(H,25,26)/p+1