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

Systemtic Name: methyl 3-[3-[2-(cyclopropylamino)-1,3-thiazol-4-yl]-2,5-dimethyl-pyrrol-1-yl]propanoate Openeye Name: methyl 3-[3-[2-(cyclopropylamino)thiazol-4-yl]-2,5-dimethyl-pyrrol-1-yl]propanoate CAS Name: 3-[3-[2-(cyclopropylamino)-4-thiazolyl]-2,5-dimethyl-1-pyrrolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[3-[2-(cyclopropylamino)-1,3-thiazol-4-yl]-2,5-dimethylpyrrol-1-yl]propanoate Traditional Name: 3-[3-[2-(cyclopropylamino)thiazol-4-yl]-2,5-dimethyl-pyrrol-1-yl]propionic acid methyl ester Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCC(=O)OC)C)C2=CSC(=N2)NC3CC3

Isomeric SMILES

CC1=CC(=C(N1CCC(=O)OC)C)C2=CSC(=N2)NC3CC3

InChI

InChI=1S/C16H21N3O2S/c1-10-8-13(11(2)19(10)7-6-15(20)21-3)14-9-22-16(18-14)17-12-4-5-12/h8-9,12H,4-7H2,1-3H3,(H,17,18)