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

Systemtic Name: N-[[4-carbamimidoyl-2-(3-phenylpropylamino)phenyl]methyl]-3,5-dimethoxy-4-methyl-benzamide Openeye Name: N-[[4-carbamimidoyl-2-(3-phenylpropylamino)phenyl]methyl]-3,5-dimethoxy-4-methyl-benzamide CAS Name: N-[[4-carbamimidoyl-2-(3-phenylpropylamino)phenyl]methyl]-3,5-dimethoxy-4-methylbenzamide IUPAC Name: N-[[4-carbamimidoyl-2-(3-phenylpropylamino)phenyl]methyl]-3,5-dimethoxy-4-methylbenzamide Traditional Name: N-[4-amidino-2-(3-phenylpropylamino)benzyl]-3,5-dimethoxy-4-methyl-benzamide Formula: C27H32N4O3 MolecularWeight: 460.56798

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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)NCCCC3=CC=CC=C3)OC

Isomeric SMILES

CC1=C(C=C(C=C1OC)C(=O)NCC2=C(C=C(C=C2)C(=N)N)NCCCC3=CC=CC=C3)OC

InChI

InChI=1S/C27H32N4O3/c1-18-24(33-2)15-22(16-25(18)34-3)27(32)31-17-21-12-11-20(26(28)29)14-23(21)30-13-7-10-19-8-5-4-6-9-19/h4-6,8-9,11-12,14-16,30H,7,10,13,17H2,1-3H3,(H3,28,29)(H,31,32)