1-ethyl-3-(thiophen-2-ylmethyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine

Systemtic Name: 1-ethyl-3-(thiophen-2-ylmethyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Openeye Name: 1-ethyl-3-(2-thienylmethyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine CAS Name: 1-ethyl-3-(thiophen-2-ylmethyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine IUPAC Name: 1-ethyl-3-(thiophen-2-ylmethyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Traditional Name: 1-ethyl-3-(2-thenyl)-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepine Formula: C14H19N3S MolecularWeight: 261.38576

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=NCCCCC2=C(N1)CC3=CC=CS3

Isomeric SMILES

CCN1C2=NCCCCC2=C(N1)CC3=CC=CS3

InChI

InChI=1S/C14H19N3S/c1-2-17-14-12(7-3-4-8-15-14)13(16-17)10-11-6-5-9-18-11/h5-6,9,16H,2-4,7-8,10H2,1H3