N-[[5-(1-benzofuran-2-yl)-1H-pyrazol-4-yl]methyl]-1-(2,1,3-benzothiadiazol-5-yl)-N-methyl-methanamine

Systemtic Name: N-[[5-(1-benzofuran-2-yl)-1H-pyrazol-4-yl]methyl]-1-(2,1,3-benzothiadiazol-5-yl)-N-methyl-methanamine Openeye Name: N-[[5-(benzofuran-2-yl)-1H-pyrazol-4-yl]methyl]-1-(2,1,3-benzothiadiazol-5-yl)-N-methyl-methanamine CAS Name: N-[[5-(2-benzofuranyl)-1H-pyrazol-4-yl]methyl]-1-(2,1,3-benzothiadiazol-5-yl)-N-methylmethanamine IUPAC Name: N-[[5-(1-benzofuran-2-yl)-1H-pyrazol-4-yl]methyl]-1-(2,1,3-benzothiadiazol-5-yl)-N-methylmethanamine Traditional Name: [5-(benzofuran-2-yl)-1H-pyrazol-4-yl]methyl-methyl-(piazthiol-5-ylmethyl)amine Formula: C20H17N5OS MolecularWeight: 375.44688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=NSN=C2C=C1)CC3=C(NN=C3)C4=CC5=CC=CC=C5O4

Isomeric SMILES

CN(CC1=CC2=NSN=C2C=C1)CC3=C(NN=C3)C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C20H17N5OS/c1-25(11-13-6-7-16-17(8-13)24-27-23-16)12-15-10-21-22-20(15)19-9-14-4-2-3-5-18(14)26-19/h2-10H,11-12H2,1H3,(H,21,22)