3,5-dimethyl-1-phenyl-N-[3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]pyrazole-4-carboxamide

Systemtic Name: 3,5-dimethyl-1-phenyl-N-[3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]pyrazole-4-carboxamide Openeye Name: 3,5-dimethyl-1-phenyl-N-[3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]pyrazole-4-carboxamide CAS Name: 3,5-dimethyl-1-phenyl-N-[3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]-4-pyrazolecarboxamide IUPAC Name: 3,5-dimethyl-1-phenyl-N-[3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]pyrazole-4-carboxamide Traditional Name: 3,5-dimethyl-1-phenyl-N-[3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazol[4,3-a]azepin-3-yl)phenyl]pyrazole-4-carboxamide Formula: C25H26N6O MolecularWeight: 426.51354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)NC3=CC=CC(=C3)C4=NN=C5N4CCCCC5

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)NC3=CC=CC(=C3)C4=NN=C5N4CCCCC5

InChI

InChI=1S/C25H26N6O/c1-17-23(18(2)31(29-17)21-12-5-3-6-13-21)25(32)26-20-11-9-10-19(16-20)24-28-27-22-14-7-4-8-15-30(22)24/h3,5-6,9-13,16H,4,7-8,14-15H2,1-2H3,(H,26,32)