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

Systemtic Name: ethyl 2-azanyl-1-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-4-phenyl-pyrrole-3-carboxylate Openeye Name: ethyl 2-amino-1-[4-(4-bromophenyl)thiazol-2-yl]-4-phenyl-pyrrole-3-carboxylate CAS Name: 2-amino-1-[4-(4-bromophenyl)-2-thiazolyl]-4-phenyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-1-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-4-phenylpyrrole-3-carboxylate Traditional Name: 2-amino-1-[4-(4-bromophenyl)thiazol-2-yl]-4-phenyl-pyrrole-3-carboxylic acid ethyl ester Formula: C22H18BrN3O2S MolecularWeight: 468.36622

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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=C(C=C4)Br)N

Isomeric SMILES

CCOC(=O)C1=C(N(C=C1C2=CC=CC=C2)C3=NC(=CS3)C4=CC=C(C=C4)Br)N

InChI

InChI=1S/C22H18BrN3O2S/c1-2-28-21(27)19-17(14-6-4-3-5-7-14)12-26(20(19)24)22-25-18(13-29-22)15-8-10-16(23)11-9-15/h3-13H,2,24H2,1H3