ethyl 5-[3,4-bis[(2-methylpropan-2-yl)oxycarbonylamino]thiophen-2-yl]pent-4-ynoate

Systemtic Name: ethyl 5-[3,4-bis[(2-methylpropan-2-yl)oxycarbonylamino]thiophen-2-yl]pent-4-ynoate Openeye Name: ethyl 5-[3,4-bis(tert-butoxycarbonylamino)-2-thienyl]pent-4-ynoate CAS Name: 5-[3,4-bis[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-thiophenyl]-4-pentynoic acid ethyl ester IUPAC Name: ethyl 5-[3,4-bis[(2-methylpropan-2-yl)oxycarbonylamino]thiophen-2-yl]pent-4-ynoate Traditional Name: 5-[3,4-bis(tert-butoxycarbonylamino)-2-thienyl]pent-4-ynoic acid ethyl ester Formula: C21H30N2O6S MolecularWeight: 438.5377

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC#CC1=C(C(=CS1)NC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)CCC#CC1=C(C(=CS1)NC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C21H30N2O6S/c1-8-27-16(24)12-10-9-11-15-17(23-19(26)29-21(5,6)7)14(13-30-15)22-18(25)28-20(2,3)4/h13H,8,10,12H2,1-7H3,(H,22,25)(H,23,26)