ethyl 4-([1]benzothiolo[3,2-b]quinoxalin-2-ylcarbonyl)piperazine-1-carboxylate

Systemtic Name: ethyl 4-([1]benzothiolo[3,2-b]quinoxalin-2-ylcarbonyl)piperazine-1-carboxylate Openeye Name: ethyl 4-(benzothiopheno[3,2-b]quinoxaline-2-carbonyl)piperazine-1-carboxylate CAS Name: 4-[[1]benzothiolo[3,2-b]quinoxalin-2-yl(oxo)methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-([1]benzothiolo[3,2-b]quinoxaline-2-carbonyl)piperazine-1-carboxylate Traditional Name: 4-(benzothiopheno[3,2-b]quinoxaline-2-carbonyl)piperazine-1-carboxylic acid ethyl ester Formula: C22H20N4O3S MolecularWeight: 420.4842

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC3=C(C=C2)SC4=NC5=CC=CC=C5N=C34

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC3=C(C=C2)SC4=NC5=CC=CC=C5N=C34

InChI

InChI=1S/C22H20N4O3S/c1-2-29-22(28)26-11-9-25(10-12-26)21(27)14-7-8-18-15(13-14)19-20(30-18)24-17-6-4-3-5-16(17)23-19/h3-8,13H,2,9-12H2,1H3