N-[[2-(2-azanylethylamino)-4-carbamimidoyl-phenyl]methyl]-3,5-dimethoxy-4-methyl-benzamide

Systemtic Name: N-[[2-(2-azanylethylamino)-4-carbamimidoyl-phenyl]methyl]-3,5-dimethoxy-4-methyl-benzamide Openeye Name: N-[[2-(2-aminoethylamino)-4-carbamimidoyl-phenyl]methyl]-3,5-dimethoxy-4-methyl-benzamide CAS Name: N-[[2-(2-aminoethylamino)-4-carbamimidoylphenyl]methyl]-3,5-dimethoxy-4-methylbenzamide IUPAC Name: N-[[2-(2-aminoethylamino)-4-carbamimidoylphenyl]methyl]-3,5-dimethoxy-4-methylbenzamide Traditional Name: N-[4-amidino-2-(2-aminoethylamino)benzyl]-3,5-dimethoxy-4-methyl-benzamide Formula: C20H27N5O3 MolecularWeight: 385.46008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1OC)C(=O)NCC2=C(C=C(C=C2)C(=N)N)NCCN)OC

Isomeric SMILES

CC1=C(C=C(C=C1OC)C(=O)NCC2=C(C=C(C=C2)C(=N)N)NCCN)OC

InChI

InChI=1S/C20H27N5O3/c1-12-17(27-2)9-15(10-18(12)28-3)20(26)25-11-14-5-4-13(19(22)23)8-16(14)24-7-6-21/h4-5,8-10,24H,6-7,11,21H2,1-3H3,(H3,22,23)(H,25,26)