ethyl 4-(phenazin-2-ylcarbamothioyl)piperazine-1-carboxylate

Systemtic Name: ethyl 4-(phenazin-2-ylcarbamothioyl)piperazine-1-carboxylate Openeye Name: ethyl 4-(phenazin-2-ylcarbamothioyl)piperazine-1-carboxylate CAS Name: 4-[(2-phenazinylamino)-sulfanylidenemethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(phenazin-2-ylcarbamothioyl)piperazine-1-carboxylate Traditional Name: 4-(phenazin-2-ylthiocarbamoyl)piperazine-1-carboxylic acid ethyl ester Formula: C20H21N5O2S MolecularWeight: 395.47804

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=S)NC2=CC3=NC4=CC=CC=C4N=C3C=C2

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=S)NC2=CC3=NC4=CC=CC=C4N=C3C=C2

InChI

InChI=1S/C20H21N5O2S/c1-2-27-20(26)25-11-9-24(10-12-25)19(28)21-14-7-8-17-18(13-14)23-16-6-4-3-5-15(16)22-17/h3-8,13H,2,9-12H2,1H3,(H,21,28)