4-[2-[(6-methyl-1,3-benzoxazol-2-yl)sulfanyl]ethanoylamino]benzoic acid

Systemtic Name: 4-[2-[(6-methyl-1,3-benzoxazol-2-yl)sulfanyl]ethanoylamino]benzoic acid Openeye Name: 4-[[2-[(6-methyl-1,3-benzoxazol-2-yl)sulfanyl]acetyl]amino]benzoic acid CAS Name: 4-[[2-[(6-methyl-1,3-benzoxazol-2-yl)thio]-1-oxoethyl]amino]benzoic acid IUPAC Name: 4-[[2-[(6-methyl-1,3-benzoxazol-2-yl)sulfanyl]acetyl]amino]benzoic acid Traditional Name: 4-[[2-[(6-methyl-1,3-benzoxazol-2-yl)thio]acetyl]amino]benzoic acid Formula: C17H14N2O4S MolecularWeight: 342.36906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(O2)SCC(=O)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(O2)SCC(=O)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C17H14N2O4S/c1-10-2-7-13-14(8-10)23-17(19-13)24-9-15(20)18-12-5-3-11(4-6-12)16(21)22/h2-8H,9H2,1H3,(H,18,20)(H,21,22)