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

Systemtic Name: 1-methyl-3-(thiophen-2-ylmethyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Openeye Name: 1-methyl-3-(2-thienylmethyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine CAS Name: 1-methyl-3-(thiophen-2-ylmethyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine IUPAC Name: 1-methyl-3-(thiophen-2-ylmethyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Traditional Name: 1-methyl-3-(2-thenyl)-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepine Formula: C13H17N3S MolecularWeight: 247.35918

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=NCCCCC2=C(N1)CC3=CC=CS3

Isomeric SMILES

CN1C2=NCCCCC2=C(N1)CC3=CC=CS3

InChI

InChI=1S/C13H17N3S/c1-16-13-11(6-2-3-7-14-13)12(15-16)9-10-5-4-8-17-10/h4-5,8,15H,2-3,6-7,9H2,1H3