N,N-dimethyl-2-[4-(2-quinazolin-4-ylsulfanylethanoyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N,N-dimethyl-2-[4-(2-quinazolin-4-ylsulfanylethanoyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N,N-dimethyl-2-[4-(2-quinazolin-4-ylsulfanylacetyl)piperazin-1-ium-1-yl]acetamide CAS Name: N,N-dimethyl-2-[4-[1-oxo-2-(4-quinazolinylthio)ethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N,N-dimethyl-2-[4-(2-quinazolin-4-ylsulfanylacetyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N,N-dimethyl-2-[4-[2-(quinazolin-4-ylthio)acetyl]piperazin-1-ium-1-yl]acetamide Formula: C18H24N5O2S+ MolecularWeight: 374.48046

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C[NH+]1CCN(CC1)C(=O)CSC2=NC=NC3=CC=CC=C32

Isomeric SMILES

CN(C)C(=O)C[NH+]1CCN(CC1)C(=O)CSC2=NC=NC3=CC=CC=C32

InChI

InChI=1S/C18H23N5O2S/c1-21(2)16(24)11-22-7-9-23(10-8-22)17(25)12-26-18-14-5-3-4-6-15(14)19-13-20-18/h3-6,13H,7-12H2,1-2H3/p+1