(2-phenyl-1,3-thiazol-4-yl)methyl 4-(2,5-dimethylpyrrol-1-yl)benzoate

Systemtic Name: (2-phenyl-1,3-thiazol-4-yl)methyl 4-(2,5-dimethylpyrrol-1-yl)benzoate Openeye Name: (2-phenylthiazol-4-yl)methyl 4-(2,5-dimethylpyrrol-1-yl)benzoate CAS Name: 4-(2,5-dimethyl-1-pyrrolyl)benzoic acid (2-phenyl-4-thiazolyl)methyl ester IUPAC Name: (2-phenyl-1,3-thiazol-4-yl)methyl 4-(2,5-dimethylpyrrol-1-yl)benzoate Traditional Name: 4-(2,5-dimethylpyrrol-1-yl)benzoic acid (2-phenylthiazol-4-yl)methyl ester Formula: C23H20N2O2S MolecularWeight: 388.4821

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)OCC3=CSC(=N3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)OCC3=CSC(=N3)C4=CC=CC=C4)C

InChI

InChI=1S/C23H20N2O2S/c1-16-8-9-17(2)25(16)21-12-10-19(11-13-21)23(26)27-14-20-15-28-22(24-20)18-6-4-3-5-7-18/h3-13,15H,14H2,1-2H3