methyl 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbonylamino)-1,3-thiazole-5-carboxylate

Systemtic Name: methyl 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbonylamino)-1,3-thiazole-5-carboxylate Openeye Name: methyl 2-(3,4-dihydro-2H-1,5-benzodioxepine-7-carbonylamino)thiazole-5-carboxylate CAS Name: 2-[[3,4-dihydro-2H-1,5-benzodioxepin-7-yl(oxo)methyl]amino]-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-(3,4-dihydro-2H-1,5-benzodioxepine-7-carbonylamino)-1,3-thiazole-5-carboxylate Traditional Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-carbonylamino)thiazole-5-carboxylic acid methyl ester Formula: C15H14N2O5S MolecularWeight: 334.34706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(S1)NC(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

COC(=O)C1=CN=C(S1)NC(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C15H14N2O5S/c1-20-14(19)12-8-16-15(23-12)17-13(18)9-3-4-10-11(7-9)22-6-2-5-21-10/h3-4,7-8H,2,5-6H2,1H3,(H,16,17,18)