N-[2-(3-methylphenoxy)ethyl]-2-[2-(morpholin-4-ium-4-ylmethyl)quinazolin-4-yl]sulfanyl-ethanamide

Systemtic Name: N-[2-(3-methylphenoxy)ethyl]-2-[2-(morpholin-4-ium-4-ylmethyl)quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: N-[2-(3-methylphenoxy)ethyl]-2-[2-(morpholin-4-ium-4-ylmethyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-[2-(3-methylphenoxy)ethyl]-2-[[2-(4-morpholin-4-iumylmethyl)-4-quinazolinyl]thio]acetamide IUPAC Name: N-[2-(3-methylphenoxy)ethyl]-2-[2-(morpholin-4-ium-4-ylmethyl)quinazolin-4-yl]sulfanylacetamide Traditional Name: N-[2-(3-methylphenoxy)ethyl]-2-[[2-(morpholin-4-ium-4-ylmethyl)quinazolin-4-yl]thio]acetamide Formula: C24H29N4O3S+ MolecularWeight: 453.57706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCNC(=O)CSC2=NC(=NC3=CC=CC=C32)C[NH+]4CCOCC4

Isomeric SMILES

CC1=CC(=CC=C1)OCCNC(=O)CSC2=NC(=NC3=CC=CC=C32)C[NH+]4CCOCC4

InChI

InChI=1S/C24H28N4O3S/c1-18-5-4-6-19(15-18)31-12-9-25-23(29)17-32-24-20-7-2-3-8-21(20)26-22(27-24)16-28-10-13-30-14-11-28/h2-8,15H,9-14,16-17H2,1H3,(H,25,29)/p+1