4-tert-butyl-N-[N-(4-chloranyl-2-methyl-phenyl)-N'-(pyridin-4-ylmethyl)carbamimidoyl]benzamide

Systemtic Name: 4-tert-butyl-N-[N-(4-chloranyl-2-methyl-phenyl)-N'-(pyridin-4-ylmethyl)carbamimidoyl]benzamide Openeye Name: 4-tert-butyl-N-[N-(4-chloro-2-methyl-phenyl)-N'-(4-pyridylmethyl)carbamimidoyl]benzamide CAS Name: 4-tert-butyl-N-[(4-chloro-2-methylanilino)-(pyridin-4-ylmethylimino)methyl]benzamide IUPAC Name: 4-tert-butyl-N-[N-(4-chloro-2-methylphenyl)-N'-(pyridin-4-ylmethyl)carbamimidoyl]benzamide Traditional Name: 4-tert-butyl-N-[N-(4-chloro-2-methyl-phenyl)-N'-(4-pyridylmethyl)amidino]benzamide Formula: C25H27ClN4O MolecularWeight: 434.96108

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H27ClN4O/c1-17-15-21(26)9-10-22(17)29-24(28-16-18-11-13-27-14-12-18)30-23(31)19-5-7-20(8-6-19)25(2,3)4/h5-15H,16H2,1-4H3,(H2,28,29,30,31)