N-[(2-phenylpyrazol-3-yl)methyl]-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]cycloheptanecarboxamide

Systemtic Name: N-[(2-phenylpyrazol-3-yl)methyl]-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]cycloheptanecarboxamide Openeye Name: N-[(2-phenylpyrazol-3-yl)methyl]-N-[(1S)-tetralin-1-yl]cycloheptanecarboxamide CAS Name: N-[(2-phenyl-3-pyrazolyl)methyl]-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]cycloheptanecarboxamide IUPAC Name: N-[(2-phenylpyrazol-3-yl)methyl]-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]cycloheptanecarboxamide Traditional Name: N-[(2-phenylpyrazol-3-yl)methyl]-N-[(1S)-tetralin-1-yl]cycloheptanecarboxamide Formula: C28H33N3O MolecularWeight: 427.58112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)C(=O)N(CC2=CC=NN2C3=CC=CC=C3)C4CCCC5=CC=CC=C45

Isomeric SMILES

C1CCCC(CC1)C(=O)N(CC2=CC=NN2C3=CC=CC=C3)[C@H]4CCCC5=CC=CC=C45

InChI

InChI=1S/C28H33N3O/c32-28(23-12-4-1-2-5-13-23)30(27-18-10-14-22-11-8-9-17-26(22)27)21-25-19-20-29-31(25)24-15-6-3-7-16-24/h3,6-9,11,15-17,19-20,23,27H,1-2,4-5,10,12-14,18,21H2/t27-/m0/s1