2-azanyl-3-(2-oxidanyl-5-pyrrol-1-yl-phenyl)carbonyl-4-phenyl-2H-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-azanyl-3-(2-oxidanyl-5-pyrrol-1-yl-phenyl)carbonyl-4-phenyl-2H-1,3-thiazole-5-carboxylic acid Openeye Name: 2-amino-3-(2-hydroxy-5-pyrrol-1-yl-benzoyl)-4-phenyl-2H-thiazole-5-carboxylic acid CAS Name: 2-amino-3-[[2-hydroxy-5-(1-pyrrolyl)phenyl]-oxomethyl]-4-phenyl-2H-thiazole-5-carboxylic acid IUPAC Name: 2-amino-3-(2-hydroxy-5-pyrrol-1-ylbenzoyl)-4-phenyl-2H-1,3-thiazole-5-carboxylic acid Traditional Name: 2-amino-3-(2-hydroxy-5-pyrrol-1-yl-benzoyl)-4-phenyl-4-thiazoline-5-carboxylic acid Formula: C21H17N3O4S MolecularWeight: 407.44238

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(SC(N2C(=O)C3=C(C=CC(=C3)N4C=CC=C4)O)N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C(SC(N2C(=O)C3=C(C=CC(=C3)N4C=CC=C4)O)N)C(=O)O

InChI

InChI=1S/C21H17N3O4S/c22-21-24(17(18(29-21)20(27)28)13-6-2-1-3-7-13)19(26)15-12-14(8-9-16(15)25)23-10-4-5-11-23/h1-12,21,25H,22H2,(H,27,28)