2-methylpropyl 2-(2-benzo[e][1]benzofuran-1-ylethanoylamino)-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: 2-methylpropyl 2-(2-benzo[e][1]benzofuran-1-ylethanoylamino)-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: isobutyl 2-[(2-benzo[e]benzofuran-1-ylacetyl)amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[2-(1-benzo[e]benzofuranyl)-1-oxoethyl]amino]-4-methyl-5-thiazolecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-[(2-benzo[e][1]benzofuran-1-ylacetyl)amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[(2-benzo[e]benzofuran-1-ylacetyl)amino]-4-methyl-thiazole-5-carboxylic acid isobutyl ester Formula: C23H22N2O4S MolecularWeight: 422.49678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)CC2=COC3=C2C4=CC=CC=C4C=C3)C(=O)OCC(C)C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)CC2=COC3=C2C4=CC=CC=C4C=C3)C(=O)OCC(C)C

InChI

InChI=1S/C23H22N2O4S/c1-13(2)11-29-22(27)21-14(3)24-23(30-21)25-19(26)10-16-12-28-18-9-8-15-6-4-5-7-17(15)20(16)18/h4-9,12-13H,10-11H2,1-3H3,(H,24,25,26)