4-tert-butyl-N-[N-(2-ethylphenyl)-N'-(pyridin-4-ylmethyl)carbamimidoyl]benzamide

Systemtic Name: 4-tert-butyl-N-[N-(2-ethylphenyl)-N'-(pyridin-4-ylmethyl)carbamimidoyl]benzamide Openeye Name: 4-tert-butyl-N-[N-(2-ethylphenyl)-N'-(4-pyridylmethyl)carbamimidoyl]benzamide CAS Name: 4-tert-butyl-N-[(2-ethylanilino)-(pyridin-4-ylmethylimino)methyl]benzamide IUPAC Name: 4-tert-butyl-N-[N-(2-ethylphenyl)-N'-(pyridin-4-ylmethyl)carbamimidoyl]benzamide Traditional Name: 4-tert-butyl-N-[N-(2-ethylphenyl)-N'-(4-pyridylmethyl)amidino]benzamide Formula: C26H30N4O MolecularWeight: 414.5426

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=NCC2=CC=NC=C2)NC(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCC1=CC=CC=C1NC(=NCC2=CC=NC=C2)NC(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C26H30N4O/c1-5-20-8-6-7-9-23(20)29-25(28-18-19-14-16-27-17-15-19)30-24(31)21-10-12-22(13-11-21)26(2,3)4/h6-17H,5,18H2,1-4H3,(H2,28,29,30,31)