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

Systemtic Name: 1-methyl-3-(4-methylthiophen-2-yl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Openeye Name: 1-methyl-3-(4-methyl-2-thienyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine CAS Name: 1-methyl-3-(4-methyl-2-thiophenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine IUPAC Name: 1-methyl-3-(4-methylthiophen-2-yl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Traditional Name: 1-methyl-3-(4-methyl-2-thienyl)-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepine Formula: C13H17N3S MolecularWeight: 247.35918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=C1)C2=C3CCCCN=C3N(N2)C

Isomeric SMILES

CC1=CSC(=C1)C2=C3CCCCN=C3N(N2)C

InChI

InChI=1S/C13H17N3S/c1-9-7-11(17-8-9)12-10-5-3-4-6-14-13(10)16(2)15-12/h7-8,15H,3-6H2,1-2H3