methyl 6-[[4-(1,2,5-trimethylpyrrol-3-yl)-1,3-thiazol-2-yl]amino]hexanoate

Systemtic Name: methyl 6-[[4-(1,2,5-trimethylpyrrol-3-yl)-1,3-thiazol-2-yl]amino]hexanoate Openeye Name: methyl 6-[[4-(1,2,5-trimethylpyrrol-3-yl)thiazol-2-yl]amino]hexanoate CAS Name: 6-[[4-(1,2,5-trimethyl-3-pyrrolyl)-2-thiazolyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[[4-(1,2,5-trimethylpyrrol-3-yl)-1,3-thiazol-2-yl]amino]hexanoate Traditional Name: 6-[[4-(1,2,5-trimethylpyrrol-3-yl)thiazol-2-yl]amino]hexanoic acid methyl ester Formula: C17H25N3O2S MolecularWeight: 335.4643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C)C)C2=CSC(=N2)NCCCCCC(=O)OC

Isomeric SMILES

CC1=CC(=C(N1C)C)C2=CSC(=N2)NCCCCCC(=O)OC

InChI

InChI=1S/C17H25N3O2S/c1-12-10-14(13(2)20(12)3)15-11-23-17(19-15)18-9-7-5-6-8-16(21)22-4/h10-11H,5-9H2,1-4H3,(H,18,19)