(E)-3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]-1,3-thiazol-4-yl]hex-3-enoic acid

Systemtic Name: (E)-3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]-1,3-thiazol-4-yl]hex-3-enoic acid Openeye Name: (E)-3-[2-(tert-butoxycarbonylamino)thiazol-4-yl]hex-3-enoic acid CAS Name: (E)-3-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-thiazolyl]-3-hexenoic acid IUPAC Name: (E)-3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]-1,3-thiazol-4-yl]hex-3-enoic acid Traditional Name: (E)-3-[2-(tert-butoxycarbonylamino)thiazol-4-yl]hex-3-enoic acid Formula: C14H20N2O4S MolecularWeight: 312.3846

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Descriptors Computed from Structure

Canonical SMILES:

CCC=C(CC(=O)O)C1=CSC(=N1)NC(=O)OC(C)(C)C

Isomeric SMILES

CC/C=C(\CC(=O)O)/C1=CSC(=N1)NC(=O)OC(C)(C)C

InChI

InChI=1S/C14H20N2O4S/c1-5-6-9(7-11(17)18)10-8-21-12(15-10)16-13(19)20-14(2,3)4/h6,8H,5,7H2,1-4H3,(H,17,18)(H,15,16,19)/b9-6+