N3,N5-bis[2-(acridin-9-ylamino)ethyl]-1-methyl-pyrazole-3,5-dicarboxamide

Systemtic Name: N3,N5-bis[2-(acridin-9-ylamino)ethyl]-1-methyl-pyrazole-3,5-dicarboxamide Openeye Name: N3,N5-bis[2-(acridin-9-ylamino)ethyl]-1-methyl-pyrazole-3,5-dicarboxamide CAS Name: N3,N5-bis[2-(9-acridinylamino)ethyl]-1-methylpyrazole-3,5-dicarboxamide IUPAC Name: 3-N,5-N-bis[2-(acridin-9-ylamino)ethyl]-1-methylpyrazole-3,5-dicarboxamide Traditional Name: N,N'-bis[2-(acridin-9-ylamino)ethyl]-1-methyl-pyrazole-3,5-dicarboxamide Formula: C36H32N8O2 MolecularWeight: 608.69168

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=N1)C(=O)NCCNC2=C3C=CC=CC3=NC4=CC=CC=C42)C(=O)NCCNC5=C6C=CC=CC6=NC7=CC=CC=C75

Isomeric SMILES

CN1C(=CC(=N1)C(=O)NCCNC2=C3C=CC=CC3=NC4=CC=CC=C42)C(=O)NCCNC5=C6C=CC=CC6=NC7=CC=CC=C75

InChI

InChI=1S/C36H32N8O2/c1-44-32(36(46)40-21-19-38-34-25-12-4-8-16-29(25)42-30-17-9-5-13-26(30)34)22-31(43-44)35(45)39-20-18-37-33-23-10-2-6-14-27(23)41-28-15-7-3-11-24(28)33/h2-17,22H,18-21H2,1H3,(H,37,41)(H,38,42)(H,39,45)(H,40,46)