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

Systemtic Name: methyl 5-methoxy-3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]propylamino]-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-[2-(tert-butoxycarbonylamino)propylamino]-5-methoxy-benzothiophene-2-carboxylate CAS Name: 5-methoxy-3-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propylamino]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 5-methoxy-3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]propylamino]-1-benzothiophene-2-carboxylate Traditional Name: 3-[2-(tert-butoxycarbonylamino)propylamino]-5-methoxy-benzothiophene-2-carboxylic acid methyl ester Formula: C19H26N2O5S MolecularWeight: 394.48514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CNC1=C(SC2=C1C=C(C=C2)OC)C(=O)OC)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(CNC1=C(SC2=C1C=C(C=C2)OC)C(=O)OC)NC(=O)OC(C)(C)C

InChI

InChI=1S/C19H26N2O5S/c1-11(21-18(23)26-19(2,3)4)10-20-15-13-9-12(24-5)7-8-14(13)27-16(15)17(22)25-6/h7-9,11,20H,10H2,1-6H3,(H,21,23)