5-pyridin-2-ylcarbonyl-3,4-dihydro-1H-thiopyrano[4,3-b]indole-8-sulfonic acid

Systemtic Name: 5-pyridin-2-ylcarbonyl-3,4-dihydro-1H-thiopyrano[4,3-b]indole-8-sulfonic acid Openeye Name: 5-(pyridine-2-carbonyl)-3,4-dihydro-1H-thiopyrano[4,3-b]indole-8-sulfonic acid CAS Name: 5-[oxo(2-pyridinyl)methyl]-3,4-dihydro-1H-thiopyrano[4,3-b]indole-8-sulfonic acid IUPAC Name: 5-(pyridine-2-carbonyl)-3,4-dihydro-1H-thiopyrano[4,3-b]indole-8-sulfonic acid Traditional Name: 5-picolinoyl-3,4-dihydro-1H-thiopyran[4,3-b]indole-8-sulfonic acid Formula: C17H14N2O4S2 MolecularWeight: 374.43406

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCC2=C1N(C3=C2C=C(C=C3)S(=O)(=O)O)C(=O)C4=CC=CC=N4

Isomeric SMILES

C1CSCC2=C1N(C3=C2C=C(C=C3)S(=O)(=O)O)C(=O)C4=CC=CC=N4

InChI

InChI=1S/C17H14N2O4S2/c20-17(14-3-1-2-7-18-14)19-15-5-4-11(25(21,22)23)9-12(15)13-10-24-8-6-16(13)19/h1-5,7,9H,6,8,10H2,(H,21,22,23)