5-[3-(phenyldisulfanyl)propanoylamino]-1H-indole-2-carboxylic acid

Systemtic Name: 5-[3-(phenyldisulfanyl)propanoylamino]-1H-indole-2-carboxylic acid Openeye Name: 5-[3-(phenyldisulfanyl)propanoylamino]-1H-indole-2-carboxylic acid CAS Name: 5-[[1-oxo-3-(phenyldisulfanyl)propyl]amino]-1H-indole-2-carboxylic acid IUPAC Name: 5-[3-(phenyldisulfanyl)propanoylamino]-1H-indole-2-carboxylic acid Traditional Name: 5-[3-(phenyldisulfanyl)propanoylamino]-1H-indole-2-carboxylic acid Formula: C18H16N2O3S2 MolecularWeight: 372.46124

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SSCCC(=O)NC2=CC3=C(C=C2)NC(=C3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)SSCCC(=O)NC2=CC3=C(C=C2)NC(=C3)C(=O)O

InChI

InChI=1S/C18H16N2O3S2/c21-17(8-9-24-25-14-4-2-1-3-5-14)19-13-6-7-15-12(10-13)11-16(20-15)18(22)23/h1-7,10-11,20H,8-9H2,(H,19,21)(H,22,23)