methyl 3-[2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]ethanoylamino]-4-pyrrolidin-1-yl-benzoate

Systemtic Name: methyl 3-[2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]ethanoylamino]-4-pyrrolidin-1-yl-benzoate Openeye Name: methyl 3-[[2-[2-(5-methyl-2-furyl)thiazol-4-yl]acetyl]amino]-4-pyrrolidin-1-yl-benzoate CAS Name: 3-[[2-[2-(5-methyl-2-furanyl)-4-thiazolyl]-1-oxoethyl]amino]-4-(1-pyrrolidinyl)benzoic acid methyl ester IUPAC Name: methyl 3-[[2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]acetyl]amino]-4-pyrrolidin-1-ylbenzoate Traditional Name: 3-[[2-[2-(5-methyl-2-furyl)thiazol-4-yl]acetyl]amino]-4-pyrrolidino-benzoic acid methyl ester Formula: C22H23N3O4S MolecularWeight: 425.50072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2=NC(=CS2)CC(=O)NC3=C(C=CC(=C3)C(=O)OC)N4CCCC4

Isomeric SMILES

CC1=CC=C(O1)C2=NC(=CS2)CC(=O)NC3=C(C=CC(=C3)C(=O)OC)N4CCCC4

InChI

InChI=1S/C22H23N3O4S/c1-14-5-8-19(29-14)21-23-16(13-30-21)12-20(26)24-17-11-15(22(27)28-2)6-7-18(17)25-9-3-4-10-25/h5-8,11,13H,3-4,9-10,12H2,1-2H3,(H,24,26)