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

Systemtic Name: methyl 4-[2,5-dimethyl-3-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]pyrrol-1-yl]butanoate Openeye Name: methyl 4-[3-[2-(isopropylamino)thiazol-4-yl]-2,5-dimethyl-pyrrol-1-yl]butanoate CAS Name: 4-[2,5-dimethyl-3-[2-(propan-2-ylamino)-4-thiazolyl]-1-pyrrolyl]butanoic acid methyl ester IUPAC Name: methyl 4-[2,5-dimethyl-3-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]pyrrol-1-yl]butanoate Traditional Name: 4-[3-[2-(isopropylamino)thiazol-4-yl]-2,5-dimethyl-pyrrol-1-yl]butyric acid methyl ester Formula: C17H25N3O2S MolecularWeight: 335.4643

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25N3O2S/c1-11(2)18-17-19-15(10-23-17)14-9-12(3)20(13(14)4)8-6-7-16(21)22-5/h9-11H,6-8H2,1-5H3,(H,18,19)