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

Systemtic Name: methyl 4-[3-[2-(cyclopropylamino)-1,3-thiazol-4-yl]-2,5-dimethyl-pyrrol-1-yl]butanoate Openeye Name: methyl 4-[3-[2-(cyclopropylamino)thiazol-4-yl]-2,5-dimethyl-pyrrol-1-yl]butanoate CAS Name: 4-[3-[2-(cyclopropylamino)-4-thiazolyl]-2,5-dimethyl-1-pyrrolyl]butanoic acid methyl ester IUPAC Name: methyl 4-[3-[2-(cyclopropylamino)-1,3-thiazol-4-yl]-2,5-dimethylpyrrol-1-yl]butanoate Traditional Name: 4-[3-[2-(cyclopropylamino)thiazol-4-yl]-2,5-dimethyl-pyrrol-1-yl]butyric acid methyl ester Formula: C17H23N3O2S MolecularWeight: 333.44842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCCC(=O)OC)C)C2=CSC(=N2)NC3CC3

Isomeric SMILES

CC1=CC(=C(N1CCCC(=O)OC)C)C2=CSC(=N2)NC3CC3

InChI

InChI=1S/C17H23N3O2S/c1-11-9-14(12(2)20(11)8-4-5-16(21)22-3)15-10-23-17(19-15)18-13-6-7-13/h9-10,13H,4-8H2,1-3H3,(H,18,19)