3-phenyl-5-(thiophen-2-ylmethyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-5-ium

Systemtic Name: 3-phenyl-5-(thiophen-2-ylmethyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-5-ium Openeye Name: 3-phenyl-5-(2-thienylmethyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-5-ium CAS Name: 3-phenyl-5-(thiophen-2-ylmethyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-5-ium IUPAC Name: 3-phenyl-5-(thiophen-2-ylmethyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-5-ium Traditional Name: 3-phenyl-5-(2-thenyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-5-ium Formula: C17H18N3S+ MolecularWeight: 296.40992

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC2=C1NN=C2C3=CC=CC=C3)CC4=CC=CS4

Isomeric SMILES

C1C[NH+](CC2=C1NN=C2C3=CC=CC=C3)CC4=CC=CS4

InChI

InChI=1S/C17H17N3S/c1-2-5-13(6-3-1)17-15-12-20(9-8-16(15)18-19-17)11-14-7-4-10-21-14/h1-7,10H,8-9,11-12H2,(H,18,19)/p+1