4-tert-butyl-N-[N-(2,3-dimethylphenyl)-N'-(pyridin-4-ylmethyl)carbamimidoyl]benzamide

Systemtic Name: 4-tert-butyl-N-[N-(2,3-dimethylphenyl)-N'-(pyridin-4-ylmethyl)carbamimidoyl]benzamide Openeye Name: 4-tert-butyl-N-[N-(2,3-dimethylphenyl)-N'-(4-pyridylmethyl)carbamimidoyl]benzamide CAS Name: 4-tert-butyl-N-[(2,3-dimethylanilino)-(pyridin-4-ylmethylimino)methyl]benzamide IUPAC Name: 4-tert-butyl-N-[N-(2,3-dimethylphenyl)-N'-(pyridin-4-ylmethyl)carbamimidoyl]benzamide Traditional Name: 4-tert-butyl-N-[N-(2,3-dimethylphenyl)-N'-(4-pyridylmethyl)amidino]benzamide Formula: C26H30N4O MolecularWeight: 414.5426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=NCC2=CC=NC=C2)NC(=O)C3=CC=C(C=C3)C(C)(C)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=NCC2=CC=NC=C2)NC(=O)C3=CC=C(C=C3)C(C)(C)C)C

InChI

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