6-[4-(2,4-dichlorophenyl)carbonylpiperazin-1-yl]-N-(3-methylbutyl)pyridazine-3-carboxamide

Systemtic Name: 6-[4-(2,4-dichlorophenyl)carbonylpiperazin-1-yl]-N-(3-methylbutyl)pyridazine-3-carboxamide Openeye Name: 6-[4-(2,4-dichlorobenzoyl)piperazin-1-yl]-N-isopentyl-pyridazine-3-carboxamide CAS Name: 6-[4-[(2,4-dichlorophenyl)-oxomethyl]-1-piperazinyl]-N-(3-methylbutyl)-3-pyridazinecarboxamide IUPAC Name: 6-[4-(2,4-dichlorobenzoyl)piperazin-1-yl]-N-(3-methylbutyl)pyridazine-3-carboxamide Traditional Name: 6-[4-(2,4-dichlorobenzoyl)piperazino]-N-isoamyl-pyridazine-3-carboxamide Formula: C21H25Cl2N5O2 MolecularWeight: 450.3615

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=NN=C(C=C1)N2CCN(CC2)C(=O)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC(C)CCNC(=O)C1=NN=C(C=C1)N2CCN(CC2)C(=O)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H25Cl2N5O2/c1-14(2)7-8-24-20(29)18-5-6-19(26-25-18)27-9-11-28(12-10-27)21(30)16-4-3-15(22)13-17(16)23/h3-6,13-14H,7-12H2,1-2H3,(H,24,29)