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

Systemtic Name: methyl 3-[2,5-dimethyl-3-[2-(2-methylpropylamino)-1,3-thiazol-4-yl]pyrrol-1-yl]propanoate Openeye Name: methyl 3-[3-[2-(isobutylamino)thiazol-4-yl]-2,5-dimethyl-pyrrol-1-yl]propanoate CAS Name: 3-[2,5-dimethyl-3-[2-(2-methylpropylamino)-4-thiazolyl]-1-pyrrolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[2,5-dimethyl-3-[2-(2-methylpropylamino)-1,3-thiazol-4-yl]pyrrol-1-yl]propanoate Traditional Name: 3-[3-[2-(isobutylamino)thiazol-4-yl]-2,5-dimethyl-pyrrol-1-yl]propionic acid methyl ester Formula: C17H25N3O2S MolecularWeight: 335.4643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCC(=O)OC)C)C2=CSC(=N2)NCC(C)C

Isomeric SMILES

CC1=CC(=C(N1CCC(=O)OC)C)C2=CSC(=N2)NCC(C)C

InChI

InChI=1S/C17H25N3O2S/c1-11(2)9-18-17-19-15(10-23-17)14-8-12(3)20(13(14)4)7-6-16(21)22-5/h8,10-11H,6-7,9H2,1-5H3,(H,18,19)