propan-2-yl 4-[[4-(2-azanyl-5-methyl-1,3-thiazol-4-yl)phenoxy]methyl]benzoate

Systemtic Name: propan-2-yl 4-[[4-(2-azanyl-5-methyl-1,3-thiazol-4-yl)phenoxy]methyl]benzoate Openeye Name: isopropyl 4-[[4-(2-amino-5-methyl-thiazol-4-yl)phenoxy]methyl]benzoate CAS Name: 4-[[4-(2-amino-5-methyl-4-thiazolyl)phenoxy]methyl]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[4-(2-amino-5-methyl-1,3-thiazol-4-yl)phenoxy]methyl]benzoate Traditional Name: 4-[[4-(2-amino-5-methyl-thiazol-4-yl)phenoxy]methyl]benzoic acid isopropyl ester Formula: C21H22N2O3S MolecularWeight: 382.47598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)N)C2=CC=C(C=C2)OCC3=CC=C(C=C3)C(=O)OC(C)C

Isomeric SMILES

CC1=C(N=C(S1)N)C2=CC=C(C=C2)OCC3=CC=C(C=C3)C(=O)OC(C)C

InChI

InChI=1S/C21H22N2O3S/c1-13(2)26-20(24)17-6-4-15(5-7-17)12-25-18-10-8-16(9-11-18)19-14(3)27-21(22)23-19/h4-11,13H,12H2,1-3H3,(H2,22,23)