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

Systemtic Name: 1-(4-methoxyphenyl)-3-thiophen-2-yl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Openeye Name: 1-(4-methoxyphenyl)-3-(2-thienyl)-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine CAS Name: 1-(4-methoxyphenyl)-3-thiophen-2-yl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine IUPAC Name: 1-(4-methoxyphenyl)-3-thiophen-2-yl-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]azepine Traditional Name: 1-(4-methoxyphenyl)-3-(2-thienyl)-4,5,6,7-tetrahydro-2H-pyrazol[3,4-b]azepine Formula: C18H19N3OS MolecularWeight: 325.42796

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C3=NCCCCC3=C(N2)C4=CC=CS4

Isomeric SMILES

COC1=CC=C(C=C1)N2C3=NCCCCC3=C(N2)C4=CC=CS4

InChI

InChI=1S/C18H19N3OS/c1-22-14-9-7-13(8-10-14)21-18-15(5-2-3-11-19-18)17(20-21)16-6-4-12-23-16/h4,6-10,12,20H,2-3,5,11H2,1H3