2-[2-(1H-indol-6-ylamino)-2-oxidanylidene-ethyl]sulfanylbenzoic acid

Systemtic Name: 2-[2-(1H-indol-6-ylamino)-2-oxidanylidene-ethyl]sulfanylbenzoic acid Openeye Name: 2-[2-(1H-indol-6-ylamino)-2-oxo-ethyl]sulfanylbenzoic acid CAS Name: 2-[[2-(1H-indol-6-ylamino)-2-oxoethyl]thio]benzoic acid IUPAC Name: 2-[2-(1H-indol-6-ylamino)-2-oxoethyl]sulfanylbenzoic acid Traditional Name: 2-[[2-(1H-indol-6-ylamino)-2-keto-ethyl]thio]benzoic acid Formula: C17H14N2O3S MolecularWeight: 326.36966

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)SCC(=O)NC2=CC3=C(C=C2)C=CN3

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)SCC(=O)NC2=CC3=C(C=C2)C=CN3

InChI

InChI=1S/C17H14N2O3S/c20-16(10-23-15-4-2-1-3-13(15)17(21)22)19-12-6-5-11-7-8-18-14(11)9-12/h1-9,18H,10H2,(H,19,20)(H,21,22)