2-(pyridin-2-ylmethyldisulfanyl)carbonyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylic acid

Systemtic Name: 2-(pyridin-2-ylmethyldisulfanyl)carbonyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylic acid Openeye Name: 2-(2-pyridylmethyldisulfanyl)carbonyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylic acid CAS Name: 2-[oxo-(2-pyridinylmethyldisulfanyl)methyl]-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylic acid IUPAC Name: 2-(pyridin-2-ylmethyldisulfanyl)carbonyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylic acid Traditional Name: 2-(2-pyridylmethyldisulfanyl)carbonyl-1,3,4,9-tetrahydro-$b-carboline-3-carboxylic acid Formula: C19H17N3O3S2 MolecularWeight: 399.48658

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC2=C1C3=CC=CC=C3N2)C(=O)SSCC4=CC=CC=N4)C(=O)O

Isomeric SMILES

C1C(N(CC2=C1C3=CC=CC=C3N2)C(=O)SSCC4=CC=CC=N4)C(=O)O

InChI

InChI=1S/C19H17N3O3S2/c23-18(24)17-9-14-13-6-1-2-7-15(13)21-16(14)10-22(17)19(25)27-26-11-12-5-3-4-8-20-12/h1-8,17,21H,9-11H2,(H,23,24)