(4-bromanyl-1H-indol-2-yl)-(2-pyridin-3-yl-1,2-thiazolidin-4-yl)methanone dihydrochloride

Systemtic Name: (4-bromanyl-1H-indol-2-yl)-(2-pyridin-3-yl-1,2-thiazolidin-4-yl)methanone dihydrochloride Openeye Name: (4-bromo-1H-indol-2-yl)-[2-(3-pyridyl)isothiazolidin-4-yl]methanone dihydrochloride CAS Name: (4-bromo-1H-indol-2-yl)-[2-(3-pyridinyl)-4-isothiazolidinyl]methanone dihydrochloride IUPAC Name: (4-bromo-1H-indol-2-yl)-(2-pyridin-3-yl-1,2-thiazolidin-4-yl)methanone dihydrochloride Traditional Name: (4-bromo-1H-indol-2-yl)-[2-(3-pyridyl)isothiazolidin-4-yl]methanone dihydrochloride Formula: C17H16BrCl2N3OS MolecularWeight: 461.20344

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CSN1C2=CN=CC=C2)C(=O)C3=CC4=C(N3)C=CC=C4Br.Cl.Cl

Isomeric SMILES

C1C(CSN1C2=CN=CC=C2)C(=O)C3=CC4=C(N3)C=CC=C4Br.Cl.Cl

InChI

InChI=1S/C17H14BrN3OS.2ClH/c18-14-4-1-5-15-13(14)7-16(20-15)17(22)11-9-21(23-10-11)12-3-2-6-19-8-12;;/h1-8,11,20H,9-10H2;2*1H