[3-[3-[(2-methylpropan-2-yl)oxycarbonylamino]thiophen-2-yl]-2-phenylselanyl-propyl] ethanoate

Systemtic Name: [3-[3-[(2-methylpropan-2-yl)oxycarbonylamino]thiophen-2-yl]-2-phenylselanyl-propyl] ethanoate Openeye Name: [3-[3-(tert-butoxycarbonylamino)-2-thienyl]-2-phenylselanyl-propyl] acetate CAS Name: acetic acid [3-[3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-thiophenyl]-2-(phenylseleno)propyl] ester IUPAC Name: [3-[3-[(2-methylpropan-2-yl)oxycarbonylamino]thiophen-2-yl]-2-phenylselanylpropyl] acetate Traditional Name: acetic acid [3-[3-(tert-butoxycarbonylamino)-2-thienyl]-2-(phenylseleno)propyl] ester Formula: C20H25NO4SSe MolecularWeight: 454.4418

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(CC1=C(C=CS1)NC(=O)OC(C)(C)C)[Se]C2=CC=CC=C2

Isomeric SMILES

CC(=O)OCC(CC1=C(C=CS1)NC(=O)OC(C)(C)C)[Se]C2=CC=CC=C2

InChI

InChI=1S/C20H25NO4SSe/c1-14(22)24-13-16(27-15-8-6-5-7-9-15)12-18-17(10-11-26-18)21-19(23)25-20(2,3)4/h5-11,16H,12-13H2,1-4H3,(H,21,23)