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

Systemtic Name: ethyl 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbonylamino)-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-(3,4-dihydro-2H-1,5-benzodioxepine-7-carbonylamino)-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[3,4-dihydro-2H-1,5-benzodioxepin-7-yl(oxo)methyl]amino]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(3,4-dihydro-2H-1,5-benzodioxepine-7-carbonylamino)-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-carbonylamino)-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C17H18N2O5S MolecularWeight: 362.40022

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)C2=CC3=C(C=C2)OCCCO3)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)C2=CC3=C(C=C2)OCCCO3)C

InChI

InChI=1S/C17H18N2O5S/c1-3-22-16(21)14-10(2)18-17(25-14)19-15(20)11-5-6-12-13(9-11)24-8-4-7-23-12/h5-6,9H,3-4,7-8H2,1-2H3,(H,18,19,20)