5-butyl-N-methyl-N-octyl-1-[4-phenyl-3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]pyrazole-3-carboxamide

Systemtic Name: 5-butyl-N-methyl-N-octyl-1-[4-phenyl-3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]pyrazole-3-carboxamide Openeye Name: 5-butyl-N-methyl-N-octyl-1-[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]pyrazole-3-carboxamide CAS Name: 5-butyl-N-methyl-N-octyl-1-[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]-3-pyrazolecarboxamide IUPAC Name: 5-butyl-N-methyl-N-octyl-1-[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]pyrazole-3-carboxamide Traditional Name: 5-butyl-N-methyl-N-octyl-1-[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]pyrazole-3-carboxamide Formula: C30H39N7O MolecularWeight: 513.67696

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN(C)C(=O)C1=NN(C(=C1)CCCC)C2=CC(=C(C=C2)C3=CC=CC=C3)C4=NNN=N4

Isomeric SMILES

CCCCCCCCN(C)C(=O)C1=NN(C(=C1)CCCC)C2=CC(=C(C=C2)C3=CC=CC=C3)C4=NNN=N4

InChI

InChI=1S/C30H39N7O/c1-4-6-8-9-10-14-20-36(3)30(38)28-22-24(17-7-5-2)37(33-28)25-18-19-26(23-15-12-11-13-16-23)27(21-25)29-31-34-35-32-29/h11-13,15-16,18-19,21-22H,4-10,14,17,20H2,1-3H3,(H,31,32,34,35)