N-[N-(3-bromophenyl)-N'-(pyridin-4-ylmethyl)carbamimidoyl]-3-(dimethylamino)benzamide

Systemtic Name: N-[N-(3-bromophenyl)-N'-(pyridin-4-ylmethyl)carbamimidoyl]-3-(dimethylamino)benzamide Openeye Name: N-[N-(3-bromophenyl)-N'-(4-pyridylmethyl)carbamimidoyl]-3-(dimethylamino)benzamide CAS Name: N-[(3-bromoanilino)-(pyridin-4-ylmethylimino)methyl]-3-(dimethylamino)benzamide IUPAC Name: N-[N-(3-bromophenyl)-N'-(pyridin-4-ylmethyl)carbamimidoyl]-3-(dimethylamino)benzamide Traditional Name: N-[N-(3-bromophenyl)-N'-(4-pyridylmethyl)amidino]-3-(dimethylamino)benzamide Formula: C22H22BrN5O MolecularWeight: 452.34698

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC(=C1)C(=O)NC(=NCC2=CC=NC=C2)NC3=CC(=CC=C3)Br

Isomeric SMILES

CN(C)C1=CC=CC(=C1)C(=O)NC(=NCC2=CC=NC=C2)NC3=CC(=CC=C3)Br

InChI

InChI=1S/C22H22BrN5O/c1-28(2)20-8-3-5-17(13-20)21(29)27-22(25-15-16-9-11-24-12-10-16)26-19-7-4-6-18(23)14-19/h3-14H,15H2,1-2H3,(H2,25,26,27,29)