[4-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methyl-pyrazol-4-yl]methyl]piperazin-1-yl]-thiophen-2-yl-methanone

Systemtic Name: [4-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methyl-pyrazol-4-yl]methyl]piperazin-1-yl]-thiophen-2-yl-methanone Openeye Name: [4-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methyl-pyrazol-4-yl]methyl]piperazin-1-yl]-(2-thienyl)methanone CAS Name: [4-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methyl-4-pyrazolyl]methyl]-1-piperazinyl]-thiophen-2-ylmethanone IUPAC Name: [4-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methylpyrazol-4-yl]methyl]piperazin-1-yl]-thiophen-2-ylmethanone Traditional Name: [4-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methyl-pyrazol-4-yl]methyl]piperazino]-(2-thienyl)methanone Formula: C22H24N4O3S MolecularWeight: 424.51596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC3=C(C=C2)OCCO3)CN4CCN(CC4)C(=O)C5=CC=CS5

Isomeric SMILES

CN1C=C(C(=N1)C2=CC3=C(C=C2)OCCO3)CN4CCN(CC4)C(=O)C5=CC=CS5

InChI

InChI=1S/C22H24N4O3S/c1-24-14-17(21(23-24)16-4-5-18-19(13-16)29-11-10-28-18)15-25-6-8-26(9-7-25)22(27)20-3-2-12-30-20/h2-5,12-14H,6-11,15H2,1H3