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

Systemtic Name: methyl 4-[[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazol-2-yl]carbamoyl]benzoate Openeye Name: methyl 4-[[4-(2,3-dihydro-1,4-benzodioxin-6-yl)thiazol-2-yl]carbamoyl]benzoate CAS Name: 4-[[[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-thiazolyl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazol-2-yl]carbamoyl]benzoate Traditional Name: 4-[[4-(2,3-dihydro-1,4-benzodioxin-6-yl)thiazol-2-yl]carbamoyl]benzoic acid methyl ester Formula: C20H16N2O5S MolecularWeight: 396.41644

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)NC2=NC(=CS2)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)NC2=NC(=CS2)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C20H16N2O5S/c1-25-19(24)13-4-2-12(3-5-13)18(23)22-20-21-15(11-28-20)14-6-7-16-17(10-14)27-9-8-26-16/h2-7,10-11H,8-9H2,1H3,(H,21,22,23)