ethyl 2-azanyl-1-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-4-phenyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 2-azanyl-1-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-4-phenyl-pyrrole-3-carboxylate Openeye Name: ethyl 2-amino-1-[4-(3-nitrophenyl)thiazol-2-yl]-4-phenyl-pyrrole-3-carboxylate CAS Name: 2-amino-1-[4-(3-nitrophenyl)-2-thiazolyl]-4-phenyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-1-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-4-phenylpyrrole-3-carboxylate Traditional Name: 2-amino-1-[4-(3-nitrophenyl)thiazol-2-yl]-4-phenyl-pyrrole-3-carboxylic acid ethyl ester Formula: C22H18N4O4S MolecularWeight: 434.46772

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C=C1C2=CC=CC=C2)C3=NC(=CS3)C4=CC(=CC=C4)[N+](=O)[O-])N

Isomeric SMILES

CCOC(=O)C1=C(N(C=C1C2=CC=CC=C2)C3=NC(=CS3)C4=CC(=CC=C4)[N+](=O)[O-])N

InChI

InChI=1S/C22H18N4O4S/c1-2-30-21(27)19-17(14-7-4-3-5-8-14)12-25(20(19)23)22-24-18(13-31-22)15-9-6-10-16(11-15)26(28)29/h3-13H,2,23H2,1H3