3-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-1,3-thiazol-5-yl]sulfanyl]benzoic acid

Systemtic Name: 3-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-1,3-thiazol-5-yl]sulfanyl]benzoic acid Openeye Name: 3-[2-(tert-butoxycarbonylamino)thiazol-5-yl]sulfanylbenzoic acid CAS Name: 3-[[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-thiazolyl]thio]benzoic acid IUPAC Name: 3-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-1,3-thiazol-5-yl]sulfanyl]benzoic acid Traditional Name: 3-[[2-(tert-butoxycarbonylamino)thiazol-5-yl]thio]benzoic acid Formula: C15H16N2O4S2 MolecularWeight: 352.42854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=NC=C(S1)SC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC1=NC=C(S1)SC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C15H16N2O4S2/c1-15(2,3)21-14(20)17-13-16-8-11(23-13)22-10-6-4-5-9(7-10)12(18)19/h4-8H,1-3H3,(H,18,19)(H,16,17,20)