2-(2-quinoxalin-2-ylsulfanylethanoyl)-[1,3]thiazolo[3,2-a]quinazolin-10-ium-1-olate

Systemtic Name: 2-(2-quinoxalin-2-ylsulfanylethanoyl)-[1,3]thiazolo[3,2-a]quinazolin-10-ium-1-olate Openeye Name: 2-(2-quinoxalin-2-ylsulfanylacetyl)thiazolo[3,2-a]quinazolin-10-ium-1-olate CAS Name: 2-[1-oxo-2-(2-quinoxalinylthio)ethyl]-1-thiazolo[3,2-a]quinazolin-10-iumolate IUPAC Name: 2-(2-quinoxalin-2-ylsulfanylacetyl)-[1,3]thiazolo[3,2-a]quinazolin-10-ium-1-olate Traditional Name: 2-[2-(quinoxalin-2-ylthio)acetyl]thiazolo[3,2-a]quinazolin-10-ium-1-olate Formula: C20H12N4O2S2 MolecularWeight: 404.46488

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=NC3=[N+]2C(=C(S3)C(=O)CSC4=NC5=CC=CC=C5N=C4)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=NC3=[N+]2C(=C(S3)C(=O)CSC4=NC5=CC=CC=C5N=C4)[O-]

InChI

InChI=1S/C20H12N4O2S2/c25-16(11-27-17-10-21-13-6-2-3-7-14(13)23-17)18-19(26)24-15-8-4-1-5-12(15)9-22-20(24)28-18/h1-10H,11H2