4-[2-(4,5-dihydrobenzo[g][1]benzothiol-2-ylcarbonylamino)-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxamide

Systemtic Name: 4-[2-(4,5-dihydrobenzo[g][1]benzothiol-2-ylcarbonylamino)-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxamide Openeye Name: 4-[2-(4,5-dihydrobenzo[g]benzothiophene-2-carbonylamino)thiazol-4-yl]-1H-pyrrole-2-carboxamide CAS Name: 4-[2-[[4,5-dihydrobenzo[g][1]benzothiol-2-yl(oxo)methyl]amino]-4-thiazolyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-[2-(4,5-dihydrobenzo[g][1]benzothiole-2-carbonylamino)-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxamide Traditional Name: 4-[2-(4,5-dihydrobenzo[g]benzothiophene-2-carbonylamino)thiazol-4-yl]-1H-pyrrole-2-carboxamide Formula: C21H16N4O2S2 MolecularWeight: 420.50734

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C3=CC=CC=C31)SC(=C2)C(=O)NC4=NC(=CS4)C5=CNC(=C5)C(=O)N

Isomeric SMILES

C1CC2=C(C3=CC=CC=C31)SC(=C2)C(=O)NC4=NC(=CS4)C5=CNC(=C5)C(=O)N

InChI

InChI=1S/C21H16N4O2S2/c22-19(26)15-7-13(9-23-15)16-10-28-21(24-16)25-20(27)17-8-12-6-5-11-3-1-2-4-14(11)18(12)29-17/h1-4,7-10,23H,5-6H2,(H2,22,26)(H,24,25,27)