ethyl 4-(6H-indolo[3,2-b]quinoxalin-9-ylcarbamothioyl)piperazine-1-carboxylate

Systemtic Name: ethyl 4-(6H-indolo[3,2-b]quinoxalin-9-ylcarbamothioyl)piperazine-1-carboxylate Openeye Name: ethyl 4-(6H-indolo[3,2-b]quinoxalin-9-ylcarbamothioyl)piperazine-1-carboxylate CAS Name: 4-[(6H-indolo[3,2-b]quinoxalin-9-ylamino)-sulfanylidenemethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(6H-indolo[3,2-b]quinoxalin-9-ylcarbamothioyl)piperazine-1-carboxylate Traditional Name: 4-(6H-indolo[3,2-b]quinoxalin-9-ylthiocarbamoyl)piperazine-1-carboxylic acid ethyl ester Formula: C22H22N6O2S MolecularWeight: 434.51408

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=S)NC2=CC3=C(C=C2)NC4=NC5=CC=CC=C5N=C34

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=S)NC2=CC3=C(C=C2)NC4=NC5=CC=CC=C5N=C34

InChI

InChI=1S/C22H22N6O2S/c1-2-30-22(29)28-11-9-27(10-12-28)21(31)23-14-7-8-16-15(13-14)19-20(25-16)26-18-6-4-3-5-17(18)24-19/h3-8,13H,2,9-12H2,1H3,(H,23,31)(H,25,26)