methyl 5-methoxy-3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethylamino]-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 5-methoxy-3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethylamino]-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-[2-(tert-butoxycarbonylamino)ethylamino]-5-methoxy-benzothiophene-2-carboxylate CAS Name: 5-methoxy-3-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]ethylamino]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 5-methoxy-3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethylamino]-1-benzothiophene-2-carboxylate Traditional Name: 3-[2-(tert-butoxycarbonylamino)ethylamino]-5-methoxy-benzothiophene-2-carboxylic acid methyl ester Formula: C18H24N2O5S MolecularWeight: 380.45856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCNC1=C(SC2=C1C=C(C=C2)OC)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)NCCNC1=C(SC2=C1C=C(C=C2)OC)C(=O)OC

InChI

InChI=1S/C18H24N2O5S/c1-18(2,3)25-17(22)20-9-8-19-14-12-10-11(23-4)6-7-13(12)26-15(14)16(21)24-5/h6-7,10,19H,8-9H2,1-5H3,(H,20,22)