methyl 3-[2-[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]ethanoylamino]-4-pyrrolidin-1-yl-benzoate

Systemtic Name: methyl 3-[2-[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]ethanoylamino]-4-pyrrolidin-1-yl-benzoate Openeye Name: methyl 3-[[2-[2-(3,4-dimethoxyphenyl)thiazol-4-yl]acetyl]amino]-4-pyrrolidin-1-yl-benzoate CAS Name: 3-[[2-[2-(3,4-dimethoxyphenyl)-4-thiazolyl]-1-oxoethyl]amino]-4-(1-pyrrolidinyl)benzoic acid methyl ester IUPAC Name: methyl 3-[[2-[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]acetyl]amino]-4-pyrrolidin-1-ylbenzoate Traditional Name: 3-[[2-[2-(3,4-dimethoxyphenyl)thiazol-4-yl]acetyl]amino]-4-pyrrolidino-benzoic acid methyl ester Formula: C25H27N3O5S MolecularWeight: 481.56398

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=CS2)CC(=O)NC3=C(C=CC(=C3)C(=O)OC)N4CCCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=CS2)CC(=O)NC3=C(C=CC(=C3)C(=O)OC)N4CCCC4)OC

InChI

InChI=1S/C25H27N3O5S/c1-31-21-9-7-16(13-22(21)32-2)24-26-18(15-34-24)14-23(29)27-19-12-17(25(30)33-3)6-8-20(19)28-10-4-5-11-28/h6-9,12-13,15H,4-5,10-11,14H2,1-3H3,(H,27,29)