2-(4-tert-butylphenyl)-N-[(E)-isoquinolin-5-ylmethylideneamino]-2-methyl-cyclopropane-1-carboxamide

Systemtic Name: 2-(4-tert-butylphenyl)-N-[(E)-isoquinolin-5-ylmethylideneamino]-2-methyl-cyclopropane-1-carboxamide Openeye Name: 2-(4-tert-butylphenyl)-N-[(E)-5-isoquinolylmethyleneamino]-2-methyl-cyclopropanecarboxamide CAS Name: 2-(4-tert-butylphenyl)-N-[(E)-5-isoquinolinylmethylideneamino]-2-methyl-1-cyclopropanecarboxamide IUPAC Name: 2-(4-tert-butylphenyl)-N-[(E)-isoquinolin-5-ylmethylideneamino]-2-methylcyclopropane-1-carboxamide Traditional Name: 2-(4-tert-butylphenyl)-N-[(E)-5-isoquinolylmethyleneamino]-2-methyl-cyclopropanecarboxamide Formula: C25H27N3O MolecularWeight: 385.50138

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC1C(=O)NN=CC2=CC=CC3=C2C=CN=C3)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC1(CC1C(=O)N/N=C/C2=CC=CC3=C2C=CN=C3)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C25H27N3O/c1-24(2,3)19-8-10-20(11-9-19)25(4)14-22(25)23(29)28-27-16-18-7-5-6-17-15-26-13-12-21(17)18/h5-13,15-16,22H,14H2,1-4H3,(H,28,29)/b27-16+