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

Systemtic Name: 4-[2-(1,2-dihydroacenaphthylen-5-ylcarbonylamino)-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxamide Openeye Name: 4-[2-(1,2-dihydroacenaphthylene-5-carbonylamino)thiazol-4-yl]-1H-pyrrole-2-carboxamide CAS Name: 4-[2-[[1,2-dihydroacenaphthylen-5-yl(oxo)methyl]amino]-4-thiazolyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-[2-(1,2-dihydroacenaphthylene-5-carbonylamino)-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxamide Traditional Name: 4-[2-(acenaphthene-5-carbonylamino)thiazol-4-yl]-1H-pyrrole-2-carboxamide Formula: C21H16N4O2S MolecularWeight: 388.44234

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC3=C(C=CC1=C23)C(=O)NC4=NC(=CS4)C5=CNC(=C5)C(=O)N

Isomeric SMILES

C1CC2=CC=CC3=C(C=CC1=C23)C(=O)NC4=NC(=CS4)C5=CNC(=C5)C(=O)N

InChI

InChI=1S/C21H16N4O2S/c22-19(26)16-8-13(9-23-16)17-10-28-21(24-17)25-20(27)15-7-6-12-5-4-11-2-1-3-14(15)18(11)12/h1-3,6-10,23H,4-5H2,(H2,22,26)(H,24,25,27)