1-[2-[(5-chloranylpyridin-2-yl)amino]-2-oxidanylidene-ethyl]-5-methylsulfonyl-indole-2-carboxylic acid

Systemtic Name: 1-[2-[(5-chloranylpyridin-2-yl)amino]-2-oxidanylidene-ethyl]-5-methylsulfonyl-indole-2-carboxylic acid Openeye Name: 1-[2-[(5-chloro-2-pyridyl)amino]-2-oxo-ethyl]-5-methylsulfonyl-indole-2-carboxylic acid CAS Name: 1-[2-[(5-chloro-2-pyridinyl)amino]-2-oxoethyl]-5-methylsulfonyl-2-indolecarboxylic acid IUPAC Name: 1-[2-[(5-chloropyridin-2-yl)amino]-2-oxoethyl]-5-methylsulfonylindole-2-carboxylic acid Traditional Name: 1-[2-[(5-chloro-2-pyridyl)amino]-2-keto-ethyl]-5-mesyl-indole-2-carboxylic acid Formula: C17H14ClN3O5S MolecularWeight: 407.82816

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N(C(=C2)C(=O)O)CC(=O)NC3=NC=C(C=C3)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N(C(=C2)C(=O)O)CC(=O)NC3=NC=C(C=C3)Cl

InChI

InChI=1S/C17H14ClN3O5S/c1-27(25,26)12-3-4-13-10(6-12)7-14(17(23)24)21(13)9-16(22)20-15-5-2-11(18)8-19-15/h2-8H,9H2,1H3,(H,23,24)(H,19,20,22)