[(4S)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]-(thian-4-yl)azanium

Systemtic Name: [(4S)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]-(thian-4-yl)azanium Openeye Name: [(4S)-1-(2-pyridyl)-4,5,6,7-tetrahydroindazol-4-yl]-tetrahydrothiopyran-4-yl-ammonium CAS Name: [(4S)-1-(2-pyridinyl)-4,5,6,7-tetrahydroindazol-4-yl]-(4-thianyl)ammonium IUPAC Name: [(4S)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]-(thian-4-yl)azanium Traditional Name: [(4S)-1-(2-pyridyl)-4,5,6,7-tetrahydroindazol-4-yl]-tetrahydrothiopyran-4-yl-ammonium Formula: C17H23N4S+ MolecularWeight: 315.45632

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=C(C1)N(N=C2)C3=CC=CC=N3)[NH2+]C4CCSCC4

Isomeric SMILES

C1C[C@@H](C2=C(C1)N(N=C2)C3=CC=CC=N3)[NH2+]C4CCSCC4

InChI

InChI=1S/C17H22N4S/c1-2-9-18-17(6-1)21-16-5-3-4-15(14(16)12-19-21)20-13-7-10-22-11-8-13/h1-2,6,9,12-13,15,20H,3-5,7-8,10-11H2/p+1/t15-/m0/s1