N-[3-chloranyl-4-(1,4-diazepan-1-ylcarbonyl)phenyl]-1-(4-chlorophenyl)-5-propyl-pyrazole-4-carboxamide

Systemtic Name: N-[3-chloranyl-4-(1,4-diazepan-1-ylcarbonyl)phenyl]-1-(4-chlorophenyl)-5-propyl-pyrazole-4-carboxamide Openeye Name: N-[3-chloro-4-(1,4-diazepane-1-carbonyl)phenyl]-1-(4-chlorophenyl)-5-propyl-pyrazole-4-carboxamide CAS Name: N-[3-chloro-4-[1,4-diazepan-1-yl(oxo)methyl]phenyl]-1-(4-chlorophenyl)-5-propyl-4-pyrazolecarboxamide IUPAC Name: N-[3-chloro-4-(1,4-diazepane-1-carbonyl)phenyl]-1-(4-chlorophenyl)-5-propylpyrazole-4-carboxamide Traditional Name: N-[3-chloro-4-(1,4-diazepane-1-carbonyl)phenyl]-1-(4-chlorophenyl)-5-propyl-pyrazole-4-carboxamide Formula: C25H27Cl2N5O2 MolecularWeight: 500.42018

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=NN1C2=CC=C(C=C2)Cl)C(=O)NC3=CC(=C(C=C3)C(=O)N4CCCNCC4)Cl

Isomeric SMILES

CCCC1=C(C=NN1C2=CC=C(C=C2)Cl)C(=O)NC3=CC(=C(C=C3)C(=O)N4CCCNCC4)Cl

InChI

InChI=1S/C25H27Cl2N5O2/c1-2-4-23-21(16-29-32(23)19-8-5-17(26)6-9-19)24(33)30-18-7-10-20(22(27)15-18)25(34)31-13-3-11-28-12-14-31/h5-10,15-16,28H,2-4,11-14H2,1H3,(H,30,33)