methyl 6-[3-(2-azanyl-1,3-thiazol-4-yl)-2,5-dimethyl-pyrrol-1-yl]hexanoate

Systemtic Name: methyl 6-[3-(2-azanyl-1,3-thiazol-4-yl)-2,5-dimethyl-pyrrol-1-yl]hexanoate Openeye Name: methyl 6-[3-(2-aminothiazol-4-yl)-2,5-dimethyl-pyrrol-1-yl]hexanoate CAS Name: 6-[3-(2-amino-4-thiazolyl)-2,5-dimethyl-1-pyrrolyl]hexanoic acid methyl ester IUPAC Name: methyl 6-[3-(2-amino-1,3-thiazol-4-yl)-2,5-dimethylpyrrol-1-yl]hexanoate Traditional Name: 6-[3-(2-aminothiazol-4-yl)-2,5-dimethyl-pyrrol-1-yl]hexanoic acid methyl ester Formula: C16H23N3O2S MolecularWeight: 321.43772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCCCCC(=O)OC)C)C2=CSC(=N2)N

Isomeric SMILES

CC1=CC(=C(N1CCCCCC(=O)OC)C)C2=CSC(=N2)N

InChI

InChI=1S/C16H23N3O2S/c1-11-9-13(14-10-22-16(17)18-14)12(2)19(11)8-6-4-5-7-15(20)21-3/h9-10H,4-8H2,1-3H3,(H2,17,18)