N-[(4-chloranyl-1-methyl-pyrazol-3-yl)methyl]-N-[3-(4-methylpiperazin-1-yl)propyl]-2,3-dihydro-1-benzofuran-5-carboxamide

Systemtic Name: N-[(4-chloranyl-1-methyl-pyrazol-3-yl)methyl]-N-[3-(4-methylpiperazin-1-yl)propyl]-2,3-dihydro-1-benzofuran-5-carboxamide Openeye Name: N-[(4-chloro-1-methyl-pyrazol-3-yl)methyl]-N-[3-(4-methylpiperazin-1-yl)propyl]-2,3-dihydrobenzofuran-5-carboxamide CAS Name: N-[(4-chloro-1-methyl-3-pyrazolyl)methyl]-N-[3-(4-methyl-1-piperazinyl)propyl]-2,3-dihydrobenzofuran-5-carboxamide IUPAC Name: N-[(4-chloro-1-methylpyrazol-3-yl)methyl]-N-[3-(4-methylpiperazin-1-yl)propyl]-2,3-dihydro-1-benzofuran-5-carboxamide Traditional Name: N-[(4-chloro-1-methyl-pyrazol-3-yl)methyl]-N-[3-(4-methylpiperazino)propyl]coumaran-5-carboxamide Formula: C22H30ClN5O2 MolecularWeight: 431.9589

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCN(CC2=NN(C=C2Cl)C)C(=O)C3=CC4=C(C=C3)OCC4

Isomeric SMILES

CN1CCN(CC1)CCCN(CC2=NN(C=C2Cl)C)C(=O)C3=CC4=C(C=C3)OCC4

InChI

InChI=1S/C22H30ClN5O2/c1-25-9-11-27(12-10-25)7-3-8-28(16-20-19(23)15-26(2)24-20)22(29)18-4-5-21-17(14-18)6-13-30-21/h4-5,14-15H,3,6-13,16H2,1-2H3