4-azanyl-N-[[4-carbamimidoyl-2-(pyridin-2-ylmethoxy)phenyl]methyl]-3-methyl-benzamide

Systemtic Name: 4-azanyl-N-[[4-carbamimidoyl-2-(pyridin-2-ylmethoxy)phenyl]methyl]-3-methyl-benzamide Openeye Name: 4-amino-N-[[4-carbamimidoyl-2-(2-pyridylmethoxy)phenyl]methyl]-3-methyl-benzamide CAS Name: 4-amino-N-[[4-carbamimidoyl-2-(2-pyridinylmethoxy)phenyl]methyl]-3-methylbenzamide IUPAC Name: 4-amino-N-[[4-carbamimidoyl-2-(pyridin-2-ylmethoxy)phenyl]methyl]-3-methylbenzamide Traditional Name: N-[4-amidino-2-(2-pyridylmethoxy)benzyl]-4-amino-3-methyl-benzamide Formula: C22H23N5O2 MolecularWeight: 389.45032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NCC2=C(C=C(C=C2)C(=N)N)OCC3=CC=CC=N3)N

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NCC2=C(C=C(C=C2)C(=N)N)OCC3=CC=CC=N3)N

InChI

InChI=1S/C22H23N5O2/c1-14-10-16(7-8-19(14)23)22(28)27-12-17-6-5-15(21(24)25)11-20(17)29-13-18-4-2-3-9-26-18/h2-11H,12-13,23H2,1H3,(H3,24,25)(H,27,28)