methyl 6-[[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazol-2-yl]amino]hexanoate

Systemtic Name: methyl 6-[[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazol-2-yl]amino]hexanoate Openeye Name: methyl 6-[[4-(2,3-dihydro-1,4-benzodioxin-6-yl)thiazol-2-yl]amino]hexanoate CAS Name: 6-[[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-thiazolyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazol-2-yl]amino]hexanoate Traditional Name: 6-[[4-(2,3-dihydro-1,4-benzodioxin-6-yl)thiazol-2-yl]amino]hexanoic acid methyl ester Formula: C18H22N2O4S MolecularWeight: 362.44328

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC1=NC(=CS1)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

COC(=O)CCCCCNC1=NC(=CS1)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C18H22N2O4S/c1-22-17(21)5-3-2-4-8-19-18-20-14(12-25-18)13-6-7-15-16(11-13)24-10-9-23-15/h6-7,11-12H,2-5,8-10H2,1H3,(H,19,20)