methyl 4-[3-[2-(3-methoxyphenyl)-1,3-thiazol-4-yl]-2,5-dimethyl-pyrrol-1-yl]butanoate

Systemtic Name: methyl 4-[3-[2-(3-methoxyphenyl)-1,3-thiazol-4-yl]-2,5-dimethyl-pyrrol-1-yl]butanoate Openeye Name: methyl 4-[3-[2-(3-methoxyphenyl)thiazol-4-yl]-2,5-dimethyl-pyrrol-1-yl]butanoate CAS Name: 4-[3-[2-(3-methoxyphenyl)-4-thiazolyl]-2,5-dimethyl-1-pyrrolyl]butanoic acid methyl ester IUPAC Name: methyl 4-[3-[2-(3-methoxyphenyl)-1,3-thiazol-4-yl]-2,5-dimethylpyrrol-1-yl]butanoate Traditional Name: 4-[3-[2-(3-methoxyphenyl)thiazol-4-yl]-2,5-dimethyl-pyrrol-1-yl]butyric acid methyl ester Formula: C21H24N2O3S MolecularWeight: 384.49186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCCC(=O)OC)C)C2=CSC(=N2)C3=CC(=CC=C3)OC

Isomeric SMILES

CC1=CC(=C(N1CCCC(=O)OC)C)C2=CSC(=N2)C3=CC(=CC=C3)OC

InChI

InChI=1S/C21H24N2O3S/c1-14-11-18(15(2)23(14)10-6-9-20(24)26-4)19-13-27-21(22-19)16-7-5-8-17(12-16)25-3/h5,7-8,11-13H,6,9-10H2,1-4H3