methyl (E,2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-thiophen-3-yl-pent-4-enoate

Systemtic Name: methyl (E,2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-thiophen-3-yl-pent-4-enoate Openeye Name: methyl (E,2S)-2-(tert-butoxycarbonylamino)-5-(3-thienyl)pent-4-enoate CAS Name: (E,2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-(3-thiophenyl)-4-pentenoic acid methyl ester IUPAC Name: methyl (E,2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-thiophen-3-ylpent-4-enoate Traditional Name: (E,2S)-2-(tert-butoxycarbonylamino)-5-(3-thienyl)pent-4-enoic acid methyl ester Formula: C15H21NO4S MolecularWeight: 311.39654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC=CC1=CSC=C1)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](C/C=C/C1=CSC=C1)C(=O)OC

InChI

InChI=1S/C15H21NO4S/c1-15(2,3)20-14(18)16-12(13(17)19-4)7-5-6-11-8-9-21-10-11/h5-6,8-10,12H,7H2,1-4H3,(H,16,18)/b6-5+/t12-/m0/s1