1-[(3-carbamimidoylphenyl)methyl]-N-[(1R)-1-phenylethyl]-5-phenylmethoxy-indole-2-carboxamide

Systemtic Name: 1-[(3-carbamimidoylphenyl)methyl]-N-[(1R)-1-phenylethyl]-5-phenylmethoxy-indole-2-carboxamide Openeye Name: 5-benzyloxy-1-[(3-carbamimidoylphenyl)methyl]-N-[(1R)-1-phenylethyl]indole-2-carboxamide CAS Name: 1-[(3-carbamimidoylphenyl)methyl]-N-[(1R)-1-phenylethyl]-5-phenylmethoxy-2-indolecarboxamide IUPAC Name: 1-[(3-carbamimidoylphenyl)methyl]-N-[(1R)-1-phenylethyl]-5-phenylmethoxyindole-2-carboxamide Traditional Name: 1-(3-amidinobenzyl)-5-benzoxy-N-[(1R)-1-phenylethyl]indole-2-carboxamide Formula: C32H30N4O2 MolecularWeight: 502.6062

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2=CC3=C(N2CC4=CC=CC(=C4)C(=N)N)C=CC(=C3)OCC5=CC=CC=C5

Isomeric SMILES

C[C@H](C1=CC=CC=C1)NC(=O)C2=CC3=C(N2CC4=CC=CC(=C4)C(=N)N)C=CC(=C3)OCC5=CC=CC=C5

InChI

InChI=1S/C32H30N4O2/c1-22(25-12-6-3-7-13-25)35-32(37)30-19-27-18-28(38-21-23-9-4-2-5-10-23)15-16-29(27)36(30)20-24-11-8-14-26(17-24)31(33)34/h2-19,22H,20-21H2,1H3,(H3,33,34)(H,35,37)/t22-/m1/s1