[2-(3-methoxyphenyl)-1,3-thiazol-4-yl]methyl 4-(cyclopropylcarbonylamino)benzoate

Systemtic Name: [2-(3-methoxyphenyl)-1,3-thiazol-4-yl]methyl 4-(cyclopropylcarbonylamino)benzoate Openeye Name: [2-(3-methoxyphenyl)thiazol-4-yl]methyl 4-(cyclopropanecarbonylamino)benzoate CAS Name: 4-[[cyclopropyl(oxo)methyl]amino]benzoic acid [2-(3-methoxyphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(3-methoxyphenyl)-1,3-thiazol-4-yl]methyl 4-(cyclopropanecarbonylamino)benzoate Traditional Name: 4-(cyclopropanecarbonylamino)benzoic acid [2-(3-methoxyphenyl)thiazol-4-yl]methyl ester Formula: C22H20N2O4S MolecularWeight: 408.4702

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NC(=CS2)COC(=O)C3=CC=C(C=C3)NC(=O)C4CC4

Isomeric SMILES

COC1=CC=CC(=C1)C2=NC(=CS2)COC(=O)C3=CC=C(C=C3)NC(=O)C4CC4

InChI

InChI=1S/C22H20N2O4S/c1-27-19-4-2-3-16(11-19)21-24-18(13-29-21)12-28-22(26)15-7-9-17(10-8-15)23-20(25)14-5-6-14/h2-4,7-11,13-14H,5-6,12H2,1H3,(H,23,25)